data_1yse_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 1yse _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.1 m -100.02 179.39 4.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.9 -19.37 65.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.199 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.408 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.0 mt-10 -51.7 -27.13 10.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.202 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 5.3 tp -57.7 -43.65 84.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.998 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -72.06 -38.16 69.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.785 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -32.95 73.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.408 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.7 m0 -65.07 -43.91 90.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.53 -41.11 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.62 -37.21 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.56 -39.44 62.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.72 -36.68 81.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.07 -37.42 72.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -78.12 -31.4 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -53.46 7.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.931 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -67.39 -47.08 71.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 82.55 61.03 2.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.506 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.425 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 22.8 pt -134.46 166.2 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.813 0.339 . . . . 0.0 111.153 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.46 157.31 34.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -64.1 -31.45 72.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.95 77.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.076 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.33 -56.56 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.068 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -59.1 -30.53 68.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.001 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -76.75 -29.93 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.268 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -81.55 -31.07 32.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.985 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . 0.405 HG23 ' CE2' ' A' ' 432' ' ' PHE . 30.8 m -88.47 -27.15 5.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.274 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -80.35 -52.43 7.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.072 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.407 ' O ' ' CG ' ' A' ' 398' ' ' PHE . 3.0 p90 -154.92 89.26 1.22 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.886 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.55 120.34 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -161.91 -72.14 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.819 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -164.29 129.97 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.051 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.46 151.43 41.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.822 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.46 -28.01 14.98 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.458 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.52 -39.81 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.861 0.362 . . . . 0.0 110.939 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.74 -29.48 66.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.029 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.9 t -68.93 -43.0 75.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -69.74 -37.46 76.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 16.4 mt -69.37 -34.08 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.232 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 3.4 mt -81.59 -31.81 32.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -66.31 -48.65 69.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.835 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -67.87 -47.58 68.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.95 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 61.21 30.0 19.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.6 136.39 55.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -74.22 144.35 81.52 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.66 -27.35 33.04 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.565 2.177 . . . . 0.0 112.231 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -38.14 77.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.974 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 m -120.73 30.55 6.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 167.41 10.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 37.5 m -85.38 175.02 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.857 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -62.74 -51.28 67.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 4.0 t -59.3 -30.82 68.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.42 -44.18 65.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.17 -36.99 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.945 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.5 -33.07 55.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.241 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.54 -48.16 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 16.1 mt -68.24 -32.74 73.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -43.64 97.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.956 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -70.85 -40.22 72.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.143 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 429' ' ' MET . . . . . 0.404 ' HE1' ' CE1' ' A' ' 398' ' ' PHE . 7.4 mtt -63.42 -31.4 72.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.939 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -70.23 -46.66 64.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -60.19 -35.91 76.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . 0.405 ' CE2' HG23 ' A' ' 396' ' ' VAL . 29.0 t80 -69.37 -38.13 77.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.93 -31.69 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -72.75 -29.6 63.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.35 159.87 10.78 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.89 151.76 73.79 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.626 2.217 . . . . 0.0 112.311 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.06 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.79 -38.77 79.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.46 -48.13 51.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 42.3 mtm180 -59.48 -34.07 72.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.932 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -64.57 -41.14 96.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.6 -33.6 74.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.87 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 20.4 mt -77.51 -40.63 28.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.068 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.425 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.5 m-85 -66.19 -35.34 80.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.962 0.41 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.878 -179.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.856 0.36 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.3 m -86.29 173.01 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.935 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 55.0 m -62.18 -24.11 67.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.123 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -53.28 -27.65 23.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 7.9 tp -57.99 -37.49 61.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.051 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -75.69 -42.69 50.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.85 -31.15 72.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.927 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 53.0 m0 -71.01 -44.28 66.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . 0.413 HG11 ' CE1' ' A' ' 393' ' ' PHE . 29.5 t -59.48 -33.87 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -76.46 -45.52 30.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -67.4 -40.24 85.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.004 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -31.69 70.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.982 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.4 mt -71.11 -32.03 68.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.979 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.36 -31.18 17.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.919 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -80.13 -32.9 38.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -80.32 -53.29 6.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.102 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 93.64 59.32 1.21 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.511 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.446 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 16.7 pt -140.34 179.23 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.918 0.389 . . . . 0.0 111.067 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.09 149.76 21.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.99 -29.6 65.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.051 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.4 -49.0 79.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.28 -50.53 67.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.127 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.413 ' CE1' HG11 ' A' ' 379' ' ' VAL . 14.0 t80 -57.78 -30.98 66.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.019 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.77 -30.28 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.72 -31.24 36.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.91 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . 0.415 HG22 ' CE2' ' A' ' 432' ' ' PHE . 16.6 m -86.05 -30.03 6.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.198 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.25 -43.14 24.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.086 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -166.98 111.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.74 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.53 124.82 20.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 400' ' ' ARG . 0.0 OUTLIER -160.74 -177.42 6.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.954 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -84.2 144.38 29.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.029 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.5 139.27 55.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 105.11 -27.61 17.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.502 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.8 tp -64.08 -55.88 18.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -32.81 70.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.966 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.18 -30.49 68.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.851 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -39.22 21.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 10.1 mt -65.61 -34.58 71.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.999 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 8.4 mt -78.74 -31.47 46.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.786 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -72.5 -44.29 62.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -60.23 -49.39 77.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.856 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.44 31.23 20.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.906 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -85.12 151.12 24.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.91 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.52 144.14 80.31 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.13 -4.32 15.21 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.529 2.153 . . . . 0.0 112.673 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -56.86 -46.39 81.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.747 0.308 . . . . 0.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 p -109.29 31.67 5.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.167 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -99.99 164.55 11.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.18 174.19 11.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.834 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.8 -39.35 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.2 p -58.73 -41.02 85.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 19.8 tp -69.04 -31.24 69.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.879 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.21 -44.51 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.7 -43.73 92.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -67.98 -44.72 76.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.1 -39.84 86.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -60.44 -41.1 93.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.867 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.102 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.36 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.43 -38.04 71.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.809 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.53 -42.91 95.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 396' ' ' VAL . 24.3 t80 -62.37 -46.42 88.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 34.0 mt -65.53 -29.74 70.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.01 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -70.06 -29.62 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.936 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 35.9 mt -58.49 147.9 67.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.004 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.86 158.76 5.91 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.576 2.184 . . . . 0.0 112.224 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.53 -31.46 72.68 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.894 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -68.28 -35.1 77.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -75.44 -39.57 58.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.906 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -59.75 -42.17 92.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.53 81.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -42.04 90.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.87 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 29.6 mt -74.76 -29.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.203 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.446 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 5.9 m-85 -69.51 -46.59 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.887 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.959 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.841 0.353 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 18.1 m -94.95 -178.44 4.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.014 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -19.72 64.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.093 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -54.0 -27.9 34.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.214 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -39.32 75.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.123 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -76.63 -34.36 58.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -30.82 63.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.0 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -68.34 -46.61 69.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.28 -39.66 79.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.172 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -68.97 -39.02 79.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -74.46 -32.48 62.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.907 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -71.03 -47.85 56.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.59 -34.28 73.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -69.87 -31.71 69.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -44.05 17.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.95 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -68.79 -55.01 12.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.085 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.9 31.61 9.13 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 17.2 pt -109.86 164.02 6.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.81 0.338 . . . . 0.0 111.09 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 152.4 41.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -31.11 69.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.91 96.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.134 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.5 t -63.41 -51.9 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -61.68 -31.15 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.19 62.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.9 ttt85 -72.26 -42.44 65.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.942 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.4 m -78.03 -33.7 18.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.19 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.86 -72.24 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.11 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.438 ' CE1' ' CE ' ' A' ' 429' ' ' MET . 3.3 p90 -131.79 114.57 14.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.32 88.8 3.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.923 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -143.92 -74.62 0.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 36.9 p -148.7 171.02 16.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.0 -33.36 10.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.991 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.89 -27.47 72.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.623 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 33.3 tp -60.84 -46.02 92.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.032 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 5.7 tt -56.95 -32.09 65.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.062 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -29.69 40.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.86 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -31.87 59.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.031 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 8.0 mt -73.56 -45.08 52.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.091 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.16 -44.62 62.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.045 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -62.4 -30.72 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.983 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -82.5 -44.51 15.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 61.55 30.51 18.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -86.97 164.86 16.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.786 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -93.18 151.97 40.87 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.39 -22.2 29.53 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.598 2.199 . . . . 0.0 112.457 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -29.95 60.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.155 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 67.9 p -100.91 -31.0 11.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -60.37 171.15 1.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.05 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.18 171.76 13.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.91 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -59.77 -31.74 69.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 p -58.75 -45.88 88.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.55 -37.53 86.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.98 -31.81 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.782 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.25 -44.08 73.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.199 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -73.8 -43.6 58.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.65 -49.2 78.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.911 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -32.18 70.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.724 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.96 92.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.972 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 429' ' ' MET . . . . . 0.438 ' CE ' ' CE1' ' A' ' 398' ' ' PHE . 41.1 mtt -62.5 -42.11 99.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.54 -41.3 96.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.836 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -60.31 -52.61 64.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.938 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -59.23 -46.27 88.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.877 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.74 -31.54 72.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.891 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -71.16 -28.37 64.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.018 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 82.9 mt -57.1 153.06 26.33 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.971 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.87 146.87 27.11 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.606 2.204 . . . . 0.0 112.386 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -64.76 -34.01 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.886 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.66 75.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.108 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -51.1 17.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -58.92 -29.48 67.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -46.92 69.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.171 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -65.75 -29.34 69.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.067 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 11.2 mt -73.03 -36.78 51.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.87 0.367 . . . . 0.0 111.026 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -71.38 -31.67 67.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.917 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 27.7 t . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.735 0.302 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 14.4 m -86.55 -174.96 5.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.954 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 63.4 p -71.88 -23.96 61.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.037 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.403 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.6 mt-10 -54.18 -27.2 32.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.139 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.3 tp -57.9 -40.95 78.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.138 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -73.93 -34.13 64.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.822 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -71.65 -33.07 68.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.403 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.9 m0 -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . 0.413 HG12 ' CE1' ' A' ' 393' ' ' PHE . 31.8 t -60.26 -47.6 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.066 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -40.85 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.803 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.25 -34.7 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.925 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.94 -41.92 73.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.3 mt -65.91 -44.41 85.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -39.5 89.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -67.17 -51.8 49.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.909 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -66.46 -62.17 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.078 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.52 28.42 7.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.502 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 10.4 pt -100.8 166.71 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 75.1 m -79.39 159.35 27.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -31.49 70.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -63.26 -38.93 93.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.148 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 27.5 t -75.7 -34.51 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.133 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.413 ' CE1' HG12 ' A' ' 379' ' ' VAL . 33.1 t80 -73.67 -43.17 60.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.946 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.85 -32.32 72.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -68.56 -55.4 11.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.42 -35.87 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.117 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -71.98 -69.15 0.41 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.205 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.7 p90 -139.68 110.68 6.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.969 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.6 93.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.66 -165.47 2.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.801 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.86 131.09 43.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -59.01 -32.23 69.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.082 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.65 -20.6 77.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.703 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.77 -48.02 76.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.8 tt -57.88 -36.65 72.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.065 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.8 p -67.15 -29.89 69.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -80.1 -35.83 36.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.956 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.2 mt -66.29 -37.1 78.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.058 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.13 -32.52 33.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -71.07 -49.58 43.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -73.57 -33.7 64.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.93 31.09 20.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.19 98.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.943 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.02 155.45 54.58 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.869 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.31 -19.25 65.46 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.656 2.237 . . . . 0.0 112.464 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -58.26 -29.53 65.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.02 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -133.91 19.15 3.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.489 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.68 146.43 23.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.133 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.48 179.04 0.65 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.907 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -66.7 -39.32 88.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.051 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -45.14 93.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.13 -33.02 73.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.802 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.53 -32.55 72.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -67.43 -51.1 55.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -63.44 -36.49 83.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.004 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.12 -38.81 79.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -63.32 -39.86 95.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.3 -38.72 92.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.112 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 3.1 ttm -67.97 -33.66 75.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.855 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -70.25 -39.92 74.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.81 -50.38 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.945 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -55.53 -41.39 73.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.2 mt -68.66 -28.78 67.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -82.48 -22.24 35.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.16 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 34.3 mt -53.93 148.79 19.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.096 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 152.13 16.2 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.578 2.185 . . . . 0.0 112.38 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.53 -36.21 81.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.856 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.06 85.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.34 -40.08 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.928 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.407 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 50.6 mtm-85 -59.45 -46.56 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -43.47 96.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.908 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -50.56 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.978 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.62 -30.65 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 16.4 m-85 -75.79 -40.79 54.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.893 -179.933 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.233 0.184 0 CA-C-O 120.801 0.334 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 69.3 m -90.57 166.38 13.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.912 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 6.2 m -59.38 -21.74 60.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.404 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.2 mt-10 -53.4 -27.78 26.01 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.189 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 5.8 tp -58.72 -45.02 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.105 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -66.23 -38.95 89.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -31.03 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.817 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.404 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 54.0 m0 -68.44 -42.14 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.04 -51.05 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.19 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -60.53 -48.94 79.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.57 -35.88 82.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -64.86 -47.03 79.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 393' ' ' PHE . 69.5 mt -60.91 -44.55 96.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.868 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -60.22 -31.58 70.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.003 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -85.41 -38.49 18.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.8 -55.62 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.056 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.09 52.16 3.53 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.419 HD12 ' CE1' ' A' ' 444' ' ' TYR . 22.7 pt -131.24 179.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.824 0.345 . . . . 0.0 111.153 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -89.88 154.49 19.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -31.09 69.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.23 94.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.158 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -71.89 -31.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.185 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.415 ' CD2' HD21 ' A' ' 383' ' ' LEU . 33.3 t80 -75.28 -43.96 48.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.003 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.98 78.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.112 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.91 -59.5 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.874 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.6 m -59.87 -39.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.013 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -66.13 -72.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.075 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.8 p90 -130.4 97.31 4.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.834 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -60.14 109.73 1.04 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.971 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -154.24 -70.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.4 170.65 8.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -97.12 131.56 43.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.8 -27.95 6.62 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.545 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.55 -45.8 85.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.2 tt -58.54 -41.74 86.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.014 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.5 m -64.41 -30.06 71.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -29.22 42.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.02 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.3 mt -80.37 -39.7 19.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 11.7 mt -76.99 -50.67 12.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.139 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -33.36 71.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.026 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -36.66 81.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 60.64 34.75 20.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -91.29 126.14 36.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -71.42 148.99 93.68 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.954 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.78 -8.39 22.99 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.579 2.186 . . . . 0.0 112.642 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -56.94 -39.42 74.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.793 0.33 . . . . 0.0 111.019 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 80.8 p -125.56 32.49 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.139 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.84 147.77 24.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.106 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 83.1 p -65.66 -178.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -72.74 -40.69 65.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 14.4 t -60.37 -43.02 96.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . 0.405 ' CD1' ' CD1' ' A' ' 426' ' ' LEU . 3.3 tm? -63.86 -40.98 97.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.18 -30.76 68.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.01 -40.2 78.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.037 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -63.25 -37.11 85.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.854 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . 0.405 ' CD1' ' CD1' ' A' ' 422' ' ' LEU . 13.9 mt -75.57 -32.04 60.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -54.1 43.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.896 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.5 86.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.5 mtm -68.17 -35.5 78.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.851 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -65.75 -41.14 92.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.874 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -60.6 -40.3 91.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -64.18 -32.71 74.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.945 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.76 -28.75 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -70.0 -29.53 66.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.982 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 3.7 mt -58.75 151.54 52.68 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 156.76 6.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.546 2.164 . . . . 0.0 112.317 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -66.05 -37.75 86.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.943 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.89 71.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.077 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.92 -38.25 64.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.925 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 36.9 mtm-85 -59.59 -47.23 86.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.816 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.41 -37.46 85.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.84 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -37.14 86.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 8.5 mt -79.16 -40.83 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.014 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.419 ' CE1' HD12 ' A' ' 388' ' ' ILE . 15.8 m-85 -60.84 -43.17 98.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.841 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.913 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.78 0.324 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 3.1 m -97.98 178.77 5.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.98 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.7 t -69.01 -21.14 64.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.118 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.74 -27.95 20.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.089 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.2 tp -58.38 -40.28 77.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -74.79 -37.26 62.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.83 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -31.37 70.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 53.0 m0 -70.7 -42.05 71.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 28.0 t -61.8 -48.29 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -49.6 65.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.901 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.75 -45.4 92.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.09 -41.12 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 5.8 mt -60.21 -31.51 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.962 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.37 -49.75 12.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 3.1 mtt-85 -62.66 -36.78 83.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -79.49 -30.53 42.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 65.5 66.96 2.2 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.482 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 16.4 pt -143.78 173.43 5.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.809 0.337 . . . . 0.0 111.196 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.3 m -91.75 154.04 19.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.945 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -60.12 -30.24 69.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.896 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.31 -41.43 89.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.156 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.6 t -75.57 -51.95 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.38 -29.28 63.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -71.02 -46.36 62.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.2 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.04 -48.69 80.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . 0.415 HG23 ' CZ ' ' A' ' 432' ' ' PHE . 21.9 m -67.42 -27.99 40.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.208 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -85.06 -76.11 0.33 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.21 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.415 ' CE1' ' HE2' ' A' ' 429' ' ' MET . 16.3 p90 -125.53 118.48 25.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -74.29 107.71 6.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.841 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -154.17 -70.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.8 t -169.99 139.18 1.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -72.73 73.4 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.926 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -179.31 -37.51 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.9 tp -61.55 -29.07 69.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.49 -37.1 72.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.968 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 89.1 p -72.71 -40.33 66.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.866 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.23 -42.13 99.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.821 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 10.6 mt -67.88 -35.09 70.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 28.6 mt -76.21 -34.36 59.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -68.86 -41.7 78.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -60.44 -33.46 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 44.01 31.84 0.56 Allowed 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.406 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 135.34 33.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -67.2 144.7 98.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.57 -0.66 10.92 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.538 2.159 . . . . 0.0 112.704 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -65.56 -37.02 85.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.987 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.1 p -123.56 25.93 8.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.269 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.03 174.9 5.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.119 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 70.2 m -69.76 171.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.819 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.42 -32.01 62.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 16.7 m -61.17 -41.14 96.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 52.3 tp -69.11 -41.26 77.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.977 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.94 -31.68 70.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 25.7 t -71.35 -47.63 58.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -64.56 -35.59 81.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.864 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.1 -41.36 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.894 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -39.32 86.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.02 -44.12 97.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 429' ' ' MET . . . . . 0.415 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 2.9 mtt -63.26 -33.26 75.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.944 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -67.48 -42.39 83.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.15 -47.2 86.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.79 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . 0.415 ' CZ ' HG23 ' A' ' 396' ' ' VAL . 32.5 t80 -62.25 -31.15 71.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 18.0 mt -84.59 -23.19 29.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.116 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -31.22 68.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.925 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.98 154.88 85.46 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.74 156.14 59.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.482 2.121 . . . . 0.0 112.237 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -58.68 -30.96 67.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.942 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.37 94.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -73.72 -37.15 65.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -59.79 -47.44 85.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.11 -41.35 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 5.2 mt -70.53 -32.95 51.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.134 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -68.15 -39.64 82.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.941 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.874 0.369 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 10.7 m -85.25 -177.07 6.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.785 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -25.88 61.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.421 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.8 mm-40 -54.79 -25.21 26.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 1.1 tp -56.99 -42.95 80.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.131 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -72.63 -42.36 64.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.82 -31.31 72.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.826 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.421 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 35.6 m0 -67.46 -40.01 85.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -57.9 -59.44 3.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.11 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 45.1 mtt-85 -54.16 -34.91 61.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.99 -30.31 58.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -78.35 -36.17 46.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.429 HD23 ' CG ' ' A' ' 393' ' ' PHE . 4.1 mm? -67.54 -44.39 78.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 52.2 tttt -69.76 -45.97 66.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.892 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.61 -54.84 41.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.94 -30.83 69.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.132 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 71.84 40.21 58.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.449 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 29.0 pt -125.37 176.86 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.162 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 95.1 p -91.61 155.42 18.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.989 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -59.19 -27.98 66.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.24 82.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.6 t -72.53 -31.32 37.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.429 ' CG ' HD23 ' A' ' 383' ' ' LEU . 71.6 t80 -73.39 -48.02 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.43 -36.99 76.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -67.35 -62.4 1.44 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . 0.416 HG23 ' CE2' ' A' ' 432' ' ' PHE . 30.7 m -59.52 -29.45 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.168 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -75.26 -58.77 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.993 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -148.27 119.21 7.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.33 99.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -169.39 -168.07 0.77 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.736 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.47 149.36 33.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.053 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.91 -31.6 71.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -66.92 -25.86 73.19 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.553 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.31 -50.36 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 0.0 111.005 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.51 -38.35 77.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.052 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.3 p -68.6 -30.82 69.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.74 -31.41 52.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.996 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 9.9 mt -80.35 -30.81 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.987 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.01 -34.62 43.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.832 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -67.79 -36.9 81.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 19.3 mmtm -60.12 -53.4 58.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 60.28 30.85 20.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -99.86 146.55 26.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.41 139.8 87.08 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.787 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -83.06 50.52 3.37 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.732 2.288 . . . . 0.0 112.606 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -100.05 -40.71 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.891 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.2 p -124.36 30.68 5.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.043 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.8 -169.62 2.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.116 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 57.8 m -90.17 172.27 8.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.04 -31.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 92.3 p -59.62 -43.58 93.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.848 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 13.1 tp -68.21 -34.86 77.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.853 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.64 -39.56 84.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.85 -44.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -64.92 -52.63 55.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.93 -31.26 69.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -44.27 70.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.48 -45.8 82.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.1 mtp -59.85 -34.24 72.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -68.77 -32.4 72.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.49 -34.34 75.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.819 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . 0.416 ' CE2' HG23 ' A' ' 396' ' ' VAL . 19.5 t80 -69.44 -35.58 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.5 mt -79.58 -30.77 41.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -72.79 -27.92 62.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.009 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.32 147.49 57.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.014 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.98 155.92 10.49 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.593 2.195 . . . . 0.0 112.249 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -66.23 -31.75 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.18 77.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.074 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -76.1 -40.17 53.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.864 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.403 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 62.2 mtm180 -70.86 -25.62 62.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.106 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.01 -49.5 50.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.062 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -41.91 99.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.094 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 15.8 mt -61.68 -50.17 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.994 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.403 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 12.5 m-85 -61.32 -30.97 70.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.938 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.839 179.915 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 29.0 t . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.831 0.348 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -70.12 169.22 13.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -16.71 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.217 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.418 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.1 mp0 -51.36 -28.15 11.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.762 0.315 . . . . 0.0 111.183 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 2.0 tp -58.51 -37.78 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.0 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -73.51 -42.95 61.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.882 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.78 -32.17 73.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.99 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.418 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.9 m0 -66.28 -41.9 89.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.921 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 32.5 t -61.15 -35.35 65.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.007 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.19 -31.39 65.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -73.8 -37.92 64.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.2 -37.84 57.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.944 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.34 -31.2 71.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.907 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -86.65 -31.26 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.79 -67.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.29 -41.94 90.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.13 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 74.18 70.88 1.18 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.488 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.417 HD11 ' CD1' ' A' ' 444' ' ' TYR . 21.1 pt -134.11 158.0 42.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.055 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.17 160.9 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -66.19 -31.43 72.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.59 69.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.212 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.5 t -84.01 -59.54 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.275 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -58.02 -26.84 62.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -81.05 -40.51 24.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.27 -39.64 59.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.169 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . 0.417 ' HB ' ' CZ ' ' A' ' 432' ' ' PHE . 27.4 m -71.61 -32.05 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.224 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -81.22 -66.51 0.88 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.401 ' CE2' ' OD1' ' A' ' 425' ' ' ASN . 16.5 p90 -128.36 114.85 17.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -59.59 109.08 0.82 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -169.57 -172.38 1.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -69.84 132.13 45.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.139 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -63.93 154.61 33.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 95.01 -24.5 28.33 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -58.97 -41.11 86.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.791 0.329 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 2.2 tp -57.38 -33.77 68.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 8.0 t -65.41 -43.74 89.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.932 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -69.08 -41.92 76.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.008 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 25.7 mt -62.58 -40.49 88.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.013 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 58.7 mt -72.18 -37.01 69.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.021 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -44.02 73.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mmmt -58.82 -39.53 81.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.013 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 59.62 30.73 20.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -93.52 109.13 20.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.29 167.6 6.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 -9.97 27.38 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.505 2.137 . . . . 0.0 112.657 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -30.04 46.23 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.02 32.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.144 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -92.74 177.0 6.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.043 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 5.3 m -89.3 173.42 8.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -41.73 97.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.934 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 57.9 m -60.82 -41.71 96.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.873 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.43 -42.47 96.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.847 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 25.7 mt -59.86 -42.24 93.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 28.0 t -62.37 -30.45 49.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.097 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . 0.401 ' OD1' ' CE2' ' A' ' 398' ' ' PHE . 1.9 m-80 -70.95 -44.88 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 28.7 mt -67.39 -44.25 79.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 11.3 mtt180 -59.88 -40.17 87.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -71.57 -34.62 70.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.3 mtt -73.35 -33.84 65.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.883 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -66.15 -46.71 76.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -64.75 -38.37 90.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . 0.417 ' CZ ' ' HB ' ' A' ' 396' ' ' VAL . 56.8 t80 -71.17 -34.45 70.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.0 mt -75.53 -30.68 59.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -72.65 -27.4 62.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.64 157.44 10.1 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.067 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.86 147.35 32.74 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.618 2.212 . . . . 0.0 112.331 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -63.98 -42.29 97.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.959 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.08 -31.66 70.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.65 -42.46 58.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -60.12 -45.19 93.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -62.23 -38.63 89.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.804 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -37.99 82.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 19.8 mt -73.65 -35.85 45.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.036 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.417 ' CD1' HD11 ' A' ' 388' ' ' ILE . 22.2 m-85 -67.14 -41.07 86.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.283 -179.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.457 -0.105 0 CA-C-O 120.902 0.382 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 39.7 m -100.02 173.65 6.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.791 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 21.5 t -58.63 -25.42 62.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -55.6 -24.74 34.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.138 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 6.0 tp -57.46 -42.54 81.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.116 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.97 -47.48 45.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.905 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.95 -28.57 66.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.042 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 41.5 m0 -68.17 -56.27 9.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.924 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . 0.418 HG11 ' CE1' ' A' ' 393' ' ' PHE . 22.3 t -58.65 -47.21 89.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -58.37 -38.72 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.66 -41.45 31.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.51 -40.2 95.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.894 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.24 -56.71 17.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.49 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -69.51 -33.01 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -86.51 -30.68 21.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 70.49 28.43 71.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.57 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 36.3 pt -106.87 164.32 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 151.86 36.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.984 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -60.78 -31.04 70.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.01 -40.21 94.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.8 t -73.65 -32.05 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.089 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.418 ' CE1' HG11 ' A' ' 379' ' ' VAL . 18.2 t80 -75.87 -51.26 12.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.62 -31.15 69.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.146 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -70.13 -43.09 71.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.932 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.01 -32.4 12.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.19 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.18 -65.8 0.76 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.193 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -135.78 106.63 6.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -70.28 95.14 0.98 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.87 -71.37 0.46 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.12 131.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.152 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.48 125.95 25.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.93 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.54 -27.69 6.8 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.507 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.3 tp -63.16 -33.17 74.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.861 0.362 . . . . 0.0 111.036 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 3.4 tt -58.57 -43.3 89.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 59.8 p -67.3 -29.66 69.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.21 -44.25 38.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 12.7 mt -67.92 -33.55 61.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.156 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.95 -30.51 56.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.944 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 -67.62 -37.15 82.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -68.47 -50.9 48.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.96 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 61.24 31.58 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -95.68 129.92 42.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.834 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.89 165.6 9.62 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.65 -8.97 24.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.614 2.209 . . . . 0.0 112.613 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -56.34 -40.66 74.82 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 t -110.74 -21.6 12.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.369 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -58.25 148.06 28.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.912 0.387 . . . . 0.0 111.109 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 33.9 m -76.89 -178.06 4.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.935 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -63.72 -30.45 71.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.9 m -57.4 -50.95 71.36 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.029 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.29 -40.19 95.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 96.3 mt -58.34 -31.99 68.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 33.0 t -74.07 -32.37 32.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.976 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -74.78 -40.96 60.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.68 -40.76 92.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -59.99 -41.17 91.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.814 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.91 94.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -38.83 73.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.9 -45.17 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.72 -39.58 80.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.878 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -70.41 -35.73 73.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.5 mt -81.3 -30.93 33.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -70.03 -29.13 66.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.903 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.19 152.53 40.99 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.917 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.03 148.47 23.61 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.524 2.149 . . . . 0.0 112.32 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -60.97 -32.85 72.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.03 -38.08 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.047 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -69.95 -40.2 75.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -60.15 -40.45 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -63.73 -37.23 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.01 -41.29 77.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 13.5 mt -69.43 -38.46 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.081 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -67.06 -33.57 75.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.936 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 2.9 m -100.16 168.11 10.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -22.86 64.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.422 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 84.2 mt-10 -53.74 -26.61 24.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.211 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.27 -44.84 84.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.196 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -73.22 -34.24 65.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -30.31 65.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.422 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 40.7 m0 -71.41 -37.8 71.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.979 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . 0.416 HG13 ' CZ ' ' A' ' 393' ' ' PHE . 21.5 t -64.72 -39.78 86.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.198 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 19.5 mtt-85 -67.97 -55.68 11.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -59.45 -30.66 68.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -78.83 -30.77 45.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.013 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 8.7 mt -68.5 -58.36 4.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -41.19 88.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.908 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -64.65 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.95 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.34 -52.32 65.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.067 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.36 69.29 1.36 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.413 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.445 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 33.9 pt -138.02 176.14 7.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 111.124 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 m -90.57 153.84 20.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.02 -30.94 69.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.88 90.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.093 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 29.8 t -74.66 -35.32 37.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.176 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.416 ' CZ ' HG13 ' A' ' 379' ' ' VAL . 42.9 t80 -72.06 -25.97 61.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.091 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.42 -55.5 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.348 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -58.38 -46.93 85.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.059 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . 0.417 HG21 ' CZ ' ' A' ' 432' ' ' PHE . 27.3 m -63.22 -33.07 58.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -84.74 -70.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.444 ' CE2' ' HG2' ' A' ' 400' ' ' ARG . 2.0 p90 -143.05 112.85 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.94 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -58.62 124.77 20.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . 0.444 ' HG2' ' CE2' ' A' ' 398' ' ' PHE . 0.0 OUTLIER -170.1 -172.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.91 113.94 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.109 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.29 131.4 10.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.374 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.36 -14.36 10.93 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.784 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.0 tp -79.76 -43.03 23.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.746 0.307 . . . . 0.0 111.04 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 9.2 tt -55.39 -28.38 53.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.21 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 24.9 p -70.95 -50.3 36.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.066 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.29 -41.38 94.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 28.4 mt -59.88 -44.62 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 7.4 mt -75.52 -30.61 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -47.6 65.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.895 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -66.89 -41.63 86.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 61.24 31.61 19.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.2 137.85 53.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -75.44 149.6 84.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.833 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.69 -5.74 17.56 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.552 2.168 . . . . 0.0 112.683 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -66.27 -57.59 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.774 0.321 . . . . 0.0 111.064 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 76.4 p -108.67 34.32 3.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.215 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 -177.26 3.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.3 174.61 8.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.979 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -71.66 -31.73 67.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.11 -39.23 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.94 -33.99 72.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 29.1 t -73.91 -38.14 49.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.071 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -69.28 -50.14 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.938 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 75.0 mt -57.63 -32.01 66.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.981 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -63.8 -45.56 89.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.25 -43.28 74.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.137 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -35.33 75.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -69.74 -44.27 70.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -64.4 -35.3 80.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.933 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . 0.417 ' CZ ' HG21 ' A' ' 396' ' ' VAL . 64.1 t80 -69.77 -33.19 72.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 11.7 mt -84.66 -30.46 24.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.876 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -70.85 -29.06 65.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.915 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 28.9 mt -57.79 158.72 11.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.31 165.47 30.35 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.639 2.226 . . . . 0.0 112.296 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.21 -33.14 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -34.95 74.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.74 -52.14 12.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.965 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.405 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 46.9 mtm180 -59.46 -30.54 68.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.996 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.71 -34.74 69.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.996 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -77.1 -31.55 56.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 7.0 mt -75.71 -40.51 40.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.053 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.445 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 13.0 m-85 -68.04 -29.48 68.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.07 -179.914 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.849 0.357 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.4 m -64.82 158.27 25.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.017 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.4 m -63.05 -21.41 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.11 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.4 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.6 mt-10 -53.03 -26.5 15.87 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.13 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 6.5 tp -57.85 -42.62 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 111.132 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . 0.45 ' CZ ' ' CD2' ' A' ' 426' ' ' LEU . 99.2 m-85 -70.47 -44.29 68.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -65.63 -31.34 72.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.947 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.4 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 45.6 m0 -70.57 -34.79 72.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.74 -37.73 80.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.031 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.8 -38.64 64.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.935 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -73.63 -34.67 65.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.949 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.9 -47.74 50.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.87 -30.88 69.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.987 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -81.68 -39.16 24.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -72.81 -32.27 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -76.5 -67.72 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 106.54 58.68 0.6 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.467 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 31.8 pt -141.53 -179.71 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 0.0 111.072 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.41 154.81 17.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.786 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -29.72 67.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.76 -47.35 86.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.161 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -51.64 49.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.15 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -58.41 -45.45 88.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -63.07 -30.08 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.185 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -51.38 12.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.943 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.51 -36.78 77.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.201 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -68.73 -58.34 4.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -150.81 111.05 4.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.097 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -75.22 119.65 19.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.59 -65.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.848 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.6 t -161.46 146.7 13.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.087 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -80.08 147.85 31.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 77.1 3.79 82.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.79 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 12.5 tp -88.31 -29.57 20.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.87 0.366 . . . . 0.0 110.93 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.66 -20.9 66.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.164 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 85.3 p -68.42 -64.93 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.202 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -53.43 -40.07 64.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.242 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.88 -33.2 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.338 . . . . 0.0 110.959 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.2 mt -91.23 -30.52 16.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.876 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 15.7 ttp85 -72.67 -40.21 66.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.22 -41.31 92.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.874 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 61.09 31.75 19.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.99 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -78.72 142.61 36.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -85.36 142.58 37.97 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.4 -25.66 25.41 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.528 2.152 . . . . 0.0 112.43 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -57.43 -47.25 82.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.01 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.7 p -110.42 28.75 8.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.205 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.13 -178.71 3.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.125 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 74.7 m -99.94 172.48 7.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -62.25 -34.0 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.941 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.27 -46.03 85.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 7.3 tp -65.36 -40.67 93.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.909 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 31.2 mt -59.65 -35.91 75.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.817 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 30.5 t -78.12 -37.19 22.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.853 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -60.69 -48.48 81.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.79 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . 0.45 ' CD2' ' CZ ' ' A' ' 376' ' ' TYR . 3.6 mt -65.12 -37.48 87.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.761 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.93 -41.95 97.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.96 92.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.018 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.0 mtm -60.67 -34.22 74.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.798 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -64.43 -45.76 86.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.743 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.36 -48.81 80.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.852 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -60.63 -31.35 70.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.832 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.34 -28.61 26.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.941 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -69.94 -34.88 74.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.21 146.89 82.54 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.64 152.4 16.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.47 2.113 . . . . 0.0 112.329 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -31.1 69.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.11 93.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.018 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.16 -40.79 74.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.85 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 28.7 mtm-85 -61.87 -38.94 90.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.828 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -66.87 -38.72 86.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -35.41 78.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.863 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 7.5 mt -81.68 -35.37 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.09 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.21 -34.7 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.939 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.23 0.031 0 CA-C-O 120.848 0.356 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.8 m -86.52 170.25 12.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -21.74 63.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.414 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 2.5 mp0 -52.15 -28.1 16.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.216 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 7.6 tp -58.81 -41.54 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.066 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -71.09 -36.44 72.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -69.31 -36.21 76.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.414 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.0 m0 -63.24 -40.48 97.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 26.2 t -58.67 -52.58 58.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -60.08 -40.6 90.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.02 -36.51 80.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.02 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.17 -46.61 61.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.03 -35.22 74.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.88 -51.28 9.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.892 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -63.72 -52.24 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.931 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.5 8.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 94.64 59.06 1.15 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.476 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 33.7 pt -138.54 165.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.334 . . . . 0.0 111.089 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.75 157.95 31.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -30.69 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.929 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.93 -36.29 76.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.287 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.49 -52.53 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.141 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -57.02 -30.89 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.68 -29.36 29.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.104 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -73.6 -46.7 45.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.958 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.56 -38.1 75.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.17 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -69.15 -57.71 5.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -153.59 105.59 2.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.845 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -73.65 97.25 2.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 23.8 mtt85 -146.21 -65.35 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.831 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 26.3 m -154.16 117.65 4.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.075 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -60.88 -23.08 64.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.209 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -91.17 17.45 55.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.875 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -100.02 -37.85 8.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.317 . . . . 0.0 110.908 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 1.6 tp -57.92 -42.77 85.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.977 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 3.3 t -64.78 -29.51 70.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.031 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -80.15 -43.15 22.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 10.6 mt -67.97 -42.73 85.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.052 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 25.5 mt -66.57 -33.6 76.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.67 -38.31 73.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -65.9 -49.88 66.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.18 31.05 20.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.919 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.63 135.58 38.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -70.49 127.73 91.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.861 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.73 54.06 5.06 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.511 2.14 . . . . 0.0 112.478 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -100.03 -43.57 6.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.805 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.0 p -128.46 31.32 5.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.094 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.34 -178.31 6.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.3 p -77.27 175.05 10.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -76.63 -31.44 57.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.932 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 3.2 t -59.46 -39.8 84.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.23 -40.8 64.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.72 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.845 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 30.4 t -60.43 -46.98 94.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.991 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -63.82 -46.42 85.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.76 -33.68 75.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.836 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -41.42 99.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.15 -49.73 76.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.994 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 6.4 ttm -66.13 -37.64 86.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -45.82 88.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -61.84 -36.74 82.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -68.91 -39.36 79.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.798 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.21 -32.38 49.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -71.04 -30.71 66.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 9.8 mt -58.92 159.5 13.34 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.4 147.83 90.73 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.549 2.166 . . . . 0.0 112.293 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.17 -29.98 67.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.15 -42.71 86.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.094 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.16 -42.42 65.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 41.6 mtm-85 -59.1 -42.22 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.68 -42.37 96.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.873 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -62.44 -50.05 73.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 5.6 mt -60.01 -42.62 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -65.65 -31.92 73.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.407 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 13.0 m -99.62 169.38 9.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.905 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 79.6 p -63.5 -21.75 66.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.116 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.418 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 9.2 mm-40 -51.86 -27.16 11.76 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 111.211 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.1 tp -57.93 -44.88 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.167 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.11 -43.6 82.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -67.61 -30.37 69.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.951 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.418 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 39.2 m0 -68.15 -42.05 80.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.948 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.3 t -59.53 -43.93 91.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -60.69 -57.19 13.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -46.36 89.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.29 -33.41 67.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.049 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.1 mt -71.14 -30.56 66.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.74 -35.0 24.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.53 -31.71 57.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.41 -44.95 15.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 73.92 63.98 2.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.447 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 41.4 pt -139.52 167.22 20.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.103 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 151.26 30.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.29 -31.77 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.828 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.47 -39.5 91.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.131 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 24.8 t -75.86 -42.35 39.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.099 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -60.43 -50.46 73.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.64 -31.56 72.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -62.38 1.71 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -62.93 -37.06 78.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.64 -63.78 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.127 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -152.03 109.48 3.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.13 94.37 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.793 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -141.92 -70.11 0.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.793 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -157.41 165.14 36.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.02 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -88.65 -25.16 22.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.069 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -84.48 -26.03 40.78 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.628 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 26.3 tp -58.59 -45.39 89.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.08 -38.29 82.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 21.4 p -69.82 -31.1 68.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.936 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.26 -40.36 64.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 11.4 mt -72.09 -47.59 53.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.35 -35.79 81.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.3 -42.37 65.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -48.78 80.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 60.27 32.93 20.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.97 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -91.07 126.6 36.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.922 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.66 151.36 71.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.7 46.49 2.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.769 2.313 . . . . 0.0 112.638 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -100.18 -34.06 10.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.748 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.4 31.15 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.42 -174.85 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 94.6 p -99.77 179.26 4.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.97 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -62.18 -52.27 64.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.041 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 2.7 t -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.936 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.91 -33.9 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.69 -40.42 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.832 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.62 -48.98 85.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.142 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.54 -42.55 91.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.959 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 5.9 mp -65.05 -32.4 74.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.0 ttm105 -65.61 -40.72 92.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.46 73.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.163 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 26.7 mtm -60.97 -34.27 74.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -70.53 -50.81 33.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.924 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.59 -35.1 75.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.33 -31.67 62.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 21.3 mt -82.29 -31.32 30.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -79.23 -26.34 42.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 8.9 mt -55.88 159.66 5.21 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.055 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -51.7 141.74 43.09 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.59 2.193 . . . . 0.0 112.435 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.75 -39.75 95.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.98 -32.38 73.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.49 -40.47 66.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.824 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.419 ' HB3' ' CE2' ' A' ' 444' ' ' TYR . 87.5 mtm-85 -59.63 -41.05 89.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.47 -45.64 93.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -60.92 -41.8 96.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.45 -34.36 52.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.033 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 440' ' ' ARG . 10.9 m-85 -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.988 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.886 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.4 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.831 0.348 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.4 m -84.18 175.06 9.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.6 t -58.6 -21.57 53.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.202 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.7 mt-10 -52.55 -26.19 12.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.208 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.0 tp -56.98 -44.36 82.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.133 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -69.72 -43.73 71.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.797 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -65.45 -31.51 72.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.411 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 36.0 m0 -65.49 -45.05 85.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.8 -38.67 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.103 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -67.83 -49.15 63.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -31.56 72.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.992 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -77.38 -31.3 54.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.986 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.89 -33.0 67.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.57 -34.39 35.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.872 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -78.53 -32.12 47.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -83.61 -56.75 3.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.94 52.47 2.24 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 4.0 pt -137.65 162.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.32 . . . . 0.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 19.7 m -74.53 150.46 39.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -60.19 -28.9 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.927 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.94 -46.4 85.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.223 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 28.8 t -69.92 -41.67 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -59.96 -36.58 77.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.015 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.7 -40.9 88.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -62.98 -51.8 65.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.19 -31.11 50.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.119 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.35 -76.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -126.93 117.99 23.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.71 95.5 6.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.788 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -145.18 -65.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.91 156.98 43.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.031 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -90.3 -32.85 16.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.06 26.79 19.27 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.522 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -99.98 -46.42 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.96 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 3.9 tt -57.89 -34.8 70.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.019 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.36 -30.88 67.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -79.42 -38.87 33.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.994 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.2 mt -63.68 -51.05 75.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.032 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.9 -38.96 83.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.85 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -37.39 83.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -63.63 -47.73 80.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 60.53 32.01 20.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.952 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.39 149.91 20.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.32 148.59 93.71 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.981 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -74.42 -5.74 17.34 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.198 . . . . 0.0 112.602 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.61 -30.99 68.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.087 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.3 t -127.02 21.07 6.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.39 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.98 171.0 15.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 32.9 t -74.16 172.54 11.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -72.72 -30.42 64.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 52.1 p -67.94 -42.4 81.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.856 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 1.1 tt -67.67 -40.75 84.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.77 -32.71 67.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 33.5 t -72.64 -35.4 50.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.984 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.77 -43.59 68.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 11.3 mt -60.07 -33.57 72.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -62.25 -56.29 20.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.86 -32.48 73.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 12.0 mtm -71.57 -36.57 70.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -66.74 -44.62 81.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.945 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -60.07 -46.01 90.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -58.14 -41.26 83.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.8 mt -71.49 -27.91 63.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.002 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -80.47 -25.03 39.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.166 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 48.9 mt -55.36 154.14 12.28 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.014 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.34 145.59 35.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.568 2.179 . . . . 0.0 112.328 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -63.74 -35.04 79.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.66 -37.89 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -75.22 -42.0 56.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -59.27 -40.33 85.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.09 -42.74 96.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -47.56 80.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 31.3 mt -59.55 -34.43 54.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.949 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.02 -43.25 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.723 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.975 179.917 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.904 0.383 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.2 m -100.01 -174.38 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.4 t -58.15 -23.44 55.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.092 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.416 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 5.2 mm-40 -55.52 -28.66 56.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.083 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 2.1 tp -59.19 -32.58 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.92 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -77.86 -42.86 32.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.94 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -32.73 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.944 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.416 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.1 m0 -69.03 -44.92 71.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.012 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 37.0 t -61.42 -40.86 87.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.06 -30.77 61.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -45.75 48.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.962 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.36 -35.93 82.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.54 -32.91 74.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -79.54 -44.24 21.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -33.97 75.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.32 -69.1 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.071 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.32 61.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.434 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 23.8 pt -137.5 164.67 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 0.0 111.116 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 p -72.32 152.43 42.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -62.42 -31.11 71.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.27 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.4 t -79.73 -40.9 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -68.21 -50.33 54.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.74 -37.55 82.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 22.2 ttt-85 -60.63 -41.22 94.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.832 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 26.9 m -85.89 -30.4 6.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.84 -65.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . 0.416 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 3.8 p90 -143.47 102.62 3.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -68.61 97.49 0.8 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.829 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -142.07 -70.67 0.34 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.32 143.53 16.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.061 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -77.64 125.78 29.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.974 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 112.05 -28.47 9.26 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.428 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.03 -31.4 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . 0.403 HD13 ' CE1' ' A' ' 398' ' ' PHE . 5.8 tt -59.21 -47.47 85.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -31.41 72.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.903 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -68.45 -39.57 81.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.988 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 6.6 mt -64.96 -35.7 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.031 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.62 -35.16 45.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.925 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -71.33 -42.89 67.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 60.29 34.3 20.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.975 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.38 142.83 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.11 149.71 89.67 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.99 -11.37 29.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.571 2.18 . . . . 0.0 112.585 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -68.62 -38.89 80.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.361 . . . . 0.0 110.966 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -99.78 -26.87 13.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -55.58 176.38 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.243 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 43.4 t -82.76 175.93 9.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.05 67.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.856 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 m -58.84 -46.6 87.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.828 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 11.5 tp -65.03 -38.91 92.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.83 -31.2 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.815 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 30.6 t -74.11 -47.38 42.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.065 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -63.75 -42.46 97.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.13 -35.16 74.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -63.51 -39.15 93.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.03 89.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.54 -36.84 79.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -66.34 -46.94 75.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -60.63 -52.94 62.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.46 -40.62 78.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.987 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.32 -26.42 61.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -72.82 -28.2 62.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.87 149.24 55.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.924 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.7 161.49 4.4 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.602 2.201 . . . . 0.0 112.34 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.39 -31.51 72.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.08 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -71.01 -42.83 69.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.409 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 78.1 mtm-85 -64.56 -42.87 95.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.07 -34.44 78.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -67.35 -47.4 70.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.837 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.57 -47.26 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 21.2 m-85 -60.77 -34.2 74.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.862 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.311 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.871 0.367 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.5 m -97.07 177.51 5.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.951 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 39.7 t -66.2 -15.47 63.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.17 -29.35 21.88 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.082 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . 0.416 ' HA ' ' CE3' ' A' ' 378' ' ' TRP . 1.5 tp -59.87 -40.18 82.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . 0.409 ' CD1' HG22 ' A' ' 375' ' ' ILE . 86.5 m-85 -70.97 -38.3 72.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -71.49 -31.35 67.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.416 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 44.2 m0 -65.48 -44.44 87.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . 0.41 HG13 ' CE1' ' A' ' 393' ' ' PHE . 22.0 t -68.64 -43.11 83.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.074 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 34.5 mtt180 -60.38 -44.62 95.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.87 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -69.46 -37.23 77.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -43.68 94.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 59.4 mt -60.41 -38.2 83.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.833 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -78.36 -31.82 48.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 11.5 mtt-85 -64.87 -65.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -74.12 -30.87 62.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.181 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 76.52 45.82 13.13 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.522 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.415 HD12 ' CE1' ' A' ' 444' ' ' TYR . 27.7 pt -108.11 165.07 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.82 0.343 . . . . 0.0 111.179 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 43.8 m -81.67 154.03 26.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -60.39 -29.2 68.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.995 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.97 -45.09 87.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.2 t -70.66 -49.9 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.04 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . 0.41 ' CE1' HG13 ' A' ' 379' ' ' VAL . 37.5 t80 -61.87 -41.02 97.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.9 70.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.161 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -48.18 16.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.924 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 16.7 m -73.79 -29.1 25.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.225 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.78 -60.96 2.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.131 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -146.89 105.88 3.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -74.29 100.67 3.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.35 -69.38 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.2 p -153.03 134.04 14.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.156 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.47 139.75 45.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 99.35 -24.59 31.6 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.581 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.6 tp -62.75 -36.16 82.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 9.1 tt -58.56 -46.85 86.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.028 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -28.85 66.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.965 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -78.71 -41.68 30.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 19.3 mt -65.7 -38.9 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 13.5 mt -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -69.45 -31.42 69.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 20.3 mttp -85.2 -45.84 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 61.28 31.95 19.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.814 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.24 169.96 9.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.08 130.37 26.31 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.832 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 -25.92 27.9 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.465 2.11 . . . . 0.0 112.364 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -58.13 -33.75 69.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.999 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 8.9 t -111.32 -19.82 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.353 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -53.78 173.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.9 0.381 . . . . 0.0 111.311 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 53.0 m -81.25 -179.78 7.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.93 67.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.846 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -46.23 88.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.879 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.2 tp -61.83 -39.9 93.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.2 mt -59.07 -32.88 70.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.738 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 22.2 t -77.67 -34.91 20.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.04 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -72.37 -47.32 50.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.57 -34.89 76.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.785 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.3 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.79 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.49 87.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.989 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.1 mtp -64.79 -35.67 81.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.808 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -62.86 -45.9 90.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.763 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -61.95 -42.96 99.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.812 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.03 -44.05 97.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.77 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 22.6 mt -71.58 -25.82 62.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.041 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -69.88 -29.38 66.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.95 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 60.3 mt -58.94 154.81 36.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.968 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.27 162.87 38.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.624 2.216 . . . . 0.0 112.275 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -59.63 -37.21 78.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.74 -38.93 92.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.08 -41.77 58.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -59.81 -45.82 91.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -62.44 -39.06 92.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -62.81 -35.55 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 8.7 mt -76.48 -34.12 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.06 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.415 ' CE1' HD12 ' A' ' 388' ' ' ILE . 12.2 m-85 -66.16 -54.07 29.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.955 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.803 0.335 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.04 -175.22 2.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -23.95 63.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.119 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.02 -28.55 62.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 6.0 tp -58.01 -35.73 53.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.146 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -76.65 -40.36 49.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.864 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -69.46 -30.97 68.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.9 m0 -67.79 -43.07 80.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.952 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -58.82 -44.55 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.129 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -72.18 -49.11 38.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.975 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.9 -30.53 69.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.992 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -80.91 -38.49 27.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.995 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.95 -40.41 94.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.969 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 -32.14 65.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.995 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.51 -31.35 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.06 -52.82 6.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 88.15 72.09 1.28 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.502 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.404 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 21.4 pt -148.77 173.59 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 111.158 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 3.2 m -90.41 152.6 20.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -30.82 70.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.862 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.64 98.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.127 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.8 t -70.61 -48.21 59.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.161 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -58.28 -48.65 79.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.53 -30.71 69.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -76.0 -55.28 5.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.867 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 23.9 m -67.04 -27.91 41.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.211 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -77.4 -73.85 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -128.92 113.08 14.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -78.8 90.54 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -132.77 -66.19 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -163.84 155.67 16.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 8.3 tm0? -85.19 137.69 32.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.7 -27.57 17.2 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.78 -31.49 69.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 110.932 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.44 -48.46 81.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 9.5 m -61.54 -38.66 88.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -40.68 90.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.002 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.4 mt -67.7 -37.28 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.118 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 91.9 mt -79.22 -27.69 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.998 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.68 -31.01 64.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -69.05 -42.81 75.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 61.25 27.59 17.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.979 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.0 161.6 13.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.864 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.0 142.78 25.26 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.979 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -54.85 -19.86 20.6 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.38 2.053 . . . . 0.0 112.584 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -49.17 -27.98 4.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.327 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 p -125.02 20.95 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.453 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.19 -173.02 2.32 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.05 178.66 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.752 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.03 -31.03 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 22.6 t -58.94 -49.94 75.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 18.2 tp -62.08 -38.32 88.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.63 -30.81 68.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.815 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.98 -50.12 39.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.204 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -60.55 -44.04 96.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 7.9 mp -65.68 -31.54 72.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.22 -51.37 69.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.16 70.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -44.29 78.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -64.08 -44.96 90.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -60.36 -40.83 92.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.09 -33.6 76.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.785 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 13.4 mt -83.74 -27.74 28.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.998 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -74.9 -28.18 60.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.984 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 161.89 4.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.33 148.39 79.74 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.513 2.142 . . . . 0.0 112.32 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.46 -31.29 69.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.963 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -46.07 90.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -45.16 68.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.961 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -58.19 -36.86 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.29 -37.58 87.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.811 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -75.0 -34.59 61.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.823 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 9.8 mt -75.75 -10.88 13.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.459 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.404 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 4.8 m-85 -95.76 -29.63 14.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.436 -179.82 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.841 0.353 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.0 m -99.8 163.1 12.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.2 t -66.31 -20.88 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.6 -27.53 11.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 111.199 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.9 tp -58.02 -44.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.109 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -66.85 -40.83 88.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -66.91 -32.35 73.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 54.6 m0 -69.07 -46.75 67.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.933 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.5 t -60.53 -33.3 53.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . 0.4 ' HB3' ' NH1' ' A' ' 380' ' ' ARG . 2.1 mmm180 -74.13 -43.55 57.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.813 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.21 -35.55 71.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.833 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.77 -36.49 78.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.891 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -35.83 79.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.851 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -72.46 -38.85 68.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -43.95 57.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.828 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.73 -32.02 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 64.54 30.81 78.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.41 HD13 ' CE1' ' A' ' 444' ' ' TYR . 42.6 pt -102.45 162.19 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.745 0.307 . . . . 0.0 111.154 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.42 151.78 42.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -62.76 -31.67 72.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.09 96.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.02 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -70.9 -43.12 77.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -61.99 -44.78 96.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.56 71.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.138 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -72.86 -35.33 67.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -87.99 -31.48 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -78.53 -63.03 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.086 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -140.12 98.42 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 97.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.919 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -136.37 -67.0 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 66.8 p -156.37 147.38 22.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.092 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.9 136.85 38.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 98.26 -27.42 19.43 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 9.8 tp -59.4 -36.03 75.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.88 -31.07 69.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.959 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 54.3 m -74.99 -44.92 45.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.98 -41.04 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 13.6 mt -69.38 -32.27 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -81.55 -30.67 33.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -44.1 61.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -45.52 91.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.952 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.99 31.3 19.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.34 151.72 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.05 146.57 63.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.94 -27.31 14.41 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.524 2.15 . . . . 0.0 112.405 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -58.39 -33.06 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.975 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 24.9 p -114.88 27.24 9.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.207 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.06 -169.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 18.5 m -99.59 173.13 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -62.79 -47.58 82.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 6.3 p -59.31 -39.82 84.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.82 -34.58 75.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.66 -35.43 67.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 24.1 t -65.69 -47.41 86.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.028 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -65.54 -37.65 87.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.93 -35.28 78.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.37 -44.9 95.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.12 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.043 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.6 mtm -64.78 -36.37 84.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -67.95 -42.87 80.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.28 -40.95 97.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -62.97 -35.7 81.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 11.3 mt -79.49 -26.63 41.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.934 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -70.0 -28.28 65.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.928 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.98 155.3 24.67 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.97 163.5 35.46 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.559 2.173 . . . . 0.0 112.286 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -59.58 -31.47 69.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.52 75.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.192 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -75.35 -51.61 12.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.406 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 6.2 mtp180 -58.76 -38.64 78.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.905 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.1 -47.99 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.951 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -39.8 77.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.033 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 18.0 mt -73.07 -45.36 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.14 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.41 ' CE1' HD13 ' A' ' 388' ' ' ILE . 16.2 m-85 -62.96 -49.95 72.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.951 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 7.9 t . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.701 0.286 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.5 m -62.78 -177.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.003 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.4 m -66.93 -22.35 65.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.054 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . 0.417 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 36.5 mt-10 -51.02 -27.39 7.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.175 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . 0.414 ' HA ' ' CE3' ' A' ' 378' ' ' TRP . 7.4 tp -59.58 -44.89 94.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -65.74 -36.87 84.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.798 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.04 -31.01 68.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.417 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.1 m0 -72.05 -45.91 58.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 30.4 t -60.47 -33.57 54.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.033 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -69.3 -41.25 77.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -37.0 50.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.951 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -61.21 -39.14 89.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.963 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 26.8 mt -74.14 -32.2 63.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.21 -31.56 62.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.967 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 16.0 mmt85 -77.96 -62.2 1.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.35 84.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.111 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 69.82 64.39 2.94 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.448 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.452 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 25.2 pt -131.56 157.28 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.759 0.314 . . . . 0.0 111.181 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 4.9 p -65.0 157.07 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -34.55 76.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.71 -30.88 69.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.108 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -77.1 -50.66 20.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -64.68 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.65 -41.79 87.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.167 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -47.65 70.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.847 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 35.7 m -69.43 -37.89 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.186 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -72.27 -70.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -134.49 113.28 11.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.857 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -60.34 96.54 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.86 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -147.79 178.82 8.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.759 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.01 151.0 46.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -67.95 149.24 50.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.946 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.29 -27.72 15.92 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.542 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.87 -34.09 74.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.834 0.35 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.76 -50.44 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.8 p -60.27 -30.64 69.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -71.49 -33.22 69.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.957 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.2 -36.25 24.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.09 -35.18 64.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -55.66 5.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -60.07 -48.41 81.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.878 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 60.13 30.96 20.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.989 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.8 115.68 6.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.49 149.17 84.64 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.49 47.36 2.33 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.844 2.363 . . . . 0.0 112.823 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -100.15 -50.87 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 0.0 110.91 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.11 30.7 6.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -90.84 -177.48 4.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.087 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.5 178.58 6.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -75.14 -30.22 60.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.964 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -50.5 73.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.089 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 56.0 tp -64.72 -41.43 95.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.65 -38.87 79.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 32.2 t -67.52 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -42.33 54.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.786 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.18 -42.3 99.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.795 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -60.53 -40.92 93.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.29 99.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.063 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.9 mtm -70.14 -34.93 73.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.822 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -69.02 -47.09 66.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.715 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -59.64 -37.59 79.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -67.88 -44.55 76.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 18.2 mt -72.49 -33.22 66.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.811 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -69.89 -31.61 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.786 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.15 159.86 13.6 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.49 148.29 87.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.464 2.109 . . . . 0.0 112.32 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.7 -30.03 67.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.994 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -57.82 -40.48 80.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.119 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -51.81 23.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 86.7 mtm-85 -59.72 -30.79 69.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -55.54 31.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.932 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.76 -43.99 97.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.976 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 24.4 mt -58.93 -30.68 43.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.048 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.452 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 15.0 m-85 -87.47 -38.25 16.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.832 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 -179.923 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 30.8 t . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.849 0.357 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.6 m -95.1 -176.69 3.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.951 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 66.4 m -66.61 -20.92 66.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.222 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -51.74 -29.62 19.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.877 0.37 . . . . 0.0 111.167 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . 0.424 ' HA ' ' CE3' ' A' ' 378' ' ' TRP . 1.0 OUTLIER -59.43 -44.23 92.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.11 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -62.93 -48.77 77.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -32.25 68.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.754 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 378' ' ' TRP . . . . . 0.424 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 54.4 m0 -64.1 -48.62 75.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.086 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 23.2 t -57.27 -42.12 79.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.353 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -60.58 -44.19 96.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -73.4 -41.84 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -42.37 95.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.048 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 15.0 mt -60.32 -49.47 77.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.861 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -70.03 -37.89 75.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -67.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.04 -45.34 93.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.191 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 84.92 72.88 1.28 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.429 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 388' ' ' ILE . . . . . 0.421 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 19.5 pt -148.41 156.17 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.833 0.349 . . . . 0.0 111.127 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.01 152.96 42.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.895 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.34 -30.07 69.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.868 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -58.52 -38.19 77.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.144 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.2 t -77.9 -50.51 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.006 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -58.2 -35.02 71.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.014 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.76 61.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.087 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -31.26 41.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -89.0 -27.9 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.181 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -76.58 -61.6 1.91 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -146.13 119.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.894 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -76.45 101.4 5.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.29 -65.9 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.65 155.78 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.054 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.09 -32.98 39.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.945 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.29 27.16 18.14 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.56 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 13.6 tp -100.09 -38.17 8.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.47 -33.71 71.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 30.8 t -76.73 -31.58 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.889 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.4 -35.61 75.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 9.9 mt -69.85 -40.49 78.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.7 mt -75.98 -31.01 58.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.898 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -71.01 -37.9 72.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.35 -39.48 78.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 61.06 29.73 19.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 136.62 32.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.21 147.23 37.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.86 -23.48 21.05 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.415 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -54.64 -29.78 53.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.065 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -130.86 19.75 5.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.297 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.13 163.64 14.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.196 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 3.1 p -80.02 -178.12 6.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.84 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -69.42 -43.89 72.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.861 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 15.8 m -58.51 -34.15 70.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -71.88 -38.13 70.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 35.8 mt -64.68 -40.4 95.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 42.3 t -66.38 -46.12 87.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.05 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -60.52 -41.5 94.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.48 -33.82 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.975 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -60.86 -44.47 96.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.82 76.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.0 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.5 ttm -68.05 -43.09 79.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -60.68 -47.97 83.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -61.43 -41.6 97.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 42.1 mt -73.71 -28.38 61.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.022 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -69.97 -38.85 76.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 5.9 mt -60.7 145.27 88.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.059 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.12 164.72 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.574 2.183 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.72 -33.41 75.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.48 81.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.021 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -50.5 41.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.715 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 88.2 mtm-85 -57.75 -36.02 71.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.784 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -54.16 49.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.09 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 10.0 mtp-105 -58.86 -47.87 83.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 56.0 mt -60.27 -28.74 42.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 444' ' ' TYR . . . . . 0.421 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.9 m-85 -72.91 -44.21 61.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.476 -179.954 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.831 0.348 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.1 m -145.97 30.99 1.04 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.16 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.03 176.89 4.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -78.94 101.63 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.098 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.1 m -100.02 179.39 4.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.9 -19.37 65.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.199 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.408 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.0 mt-10 -51.7 -27.13 10.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.202 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 5.3 tp -57.7 -43.65 84.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.998 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -72.06 -38.16 69.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.785 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -32.95 73.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.408 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.7 m0 -65.07 -43.91 90.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.53 -41.11 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.62 -37.21 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.56 -39.44 62.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.72 -36.68 81.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.07 -37.42 72.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -78.12 -31.4 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -53.46 7.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.931 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -67.39 -47.08 71.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 82.55 61.03 2.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.506 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.425 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 22.8 pt -134.46 166.2 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.813 0.339 . . . . 0.0 111.153 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.46 157.31 34.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -64.1 -31.45 72.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.95 77.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.076 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.33 -56.56 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.068 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -59.1 -30.53 68.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.001 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -76.75 -29.93 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.268 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -81.55 -31.07 32.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.985 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.405 HG23 ' CE2' ' A' ' 432' ' ' PHE . 30.8 m -88.47 -27.15 5.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.274 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -80.35 -52.43 7.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.072 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.407 ' O ' ' CG ' ' A' ' 398' ' ' PHE . 3.0 p90 -154.92 89.26 1.22 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.886 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.55 120.34 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -161.91 -72.14 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.819 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -164.29 129.97 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.051 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.46 151.43 41.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.822 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.46 -28.01 14.98 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.458 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.52 -39.81 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.861 0.362 . . . . 0.0 110.939 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.4 tt -58.74 -29.48 66.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.029 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.9 t -68.93 -43.0 75.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -69.74 -37.46 76.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 16.4 mt -69.37 -34.08 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.232 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 3.4 mt -81.59 -31.81 32.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -66.31 -48.65 69.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.835 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -67.87 -47.58 68.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.95 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 61.21 30.0 19.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.6 136.39 55.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -74.22 144.35 81.52 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.66 -27.35 33.04 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.565 2.177 . . . . 0.0 112.231 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -38.14 77.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.974 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 m -120.73 30.55 6.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 167.41 10.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 37.5 m -85.38 175.02 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.857 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -62.74 -51.28 67.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 4.0 t -59.3 -30.82 68.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.42 -44.18 65.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.17 -36.99 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.945 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.5 -33.07 55.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.241 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.54 -48.16 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 16.1 mt -68.24 -32.74 73.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -43.64 97.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.956 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -70.85 -40.22 72.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.143 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' MET . . . . . 0.404 ' HE1' ' CE1' ' A' ' 398' ' ' PHE . 7.4 mtt -63.42 -31.4 72.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.939 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -70.23 -46.66 64.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -60.19 -35.91 76.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . 0.405 ' CE2' HG23 ' A' ' 396' ' ' VAL . 29.0 t80 -69.37 -38.13 77.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.93 -31.69 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -72.75 -29.6 63.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.35 159.87 10.78 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.89 151.76 73.79 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.626 2.217 . . . . 0.0 112.311 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.06 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.79 -38.77 79.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.46 -48.13 51.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 42.3 mtm180 -59.48 -34.07 72.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.932 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -64.57 -41.14 96.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.6 -33.6 74.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.87 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 20.4 mt -77.51 -40.63 28.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.068 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.425 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.5 m-85 -66.19 -35.34 80.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.962 0.41 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -74.35 -61.36 1.89 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.878 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.23 104.46 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.942 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -131.14 -46.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -91.03 64.65 5.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.34 -40.67 87.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.905 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.63 52.7 2.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.878 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.51 106.01 0.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.46 171.0 10.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -123.48 147.36 47.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.849 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -89.93 117.56 28.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.158 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.126 179.911 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -151.1 -52.83 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.224 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -128.32 121.73 29.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.28 116.82 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.135 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.3 m -86.29 173.01 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.935 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 55.0 m -62.18 -24.11 67.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.123 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -53.28 -27.65 23.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 7.9 tp -57.99 -37.49 61.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.051 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -75.69 -42.69 50.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.85 -31.15 72.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.927 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 53.0 m0 -71.01 -44.28 66.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . 0.413 HG11 ' CE1' ' A' ' 393' ' ' PHE . 29.5 t -59.48 -33.87 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -76.46 -45.52 30.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -67.4 -40.24 85.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.004 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -31.69 70.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.982 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.4 mt -71.11 -32.03 68.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.979 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.36 -31.18 17.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.919 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -80.13 -32.9 38.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -80.32 -53.29 6.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.102 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 93.64 59.32 1.21 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.511 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.446 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 16.7 pt -140.34 179.23 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.918 0.389 . . . . 0.0 111.067 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.09 149.76 21.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.99 -29.6 65.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.051 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.4 -49.0 79.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.28 -50.53 67.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.127 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.413 ' CE1' HG11 ' A' ' 379' ' ' VAL . 14.0 t80 -57.78 -30.98 66.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.019 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.77 -30.28 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.72 -31.24 36.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.91 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.415 HG22 ' CE2' ' A' ' 432' ' ' PHE . 16.6 m -86.05 -30.03 6.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.198 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.25 -43.14 24.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.086 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -166.98 111.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.74 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.53 124.82 20.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 400' ' ' ARG . 0.0 OUTLIER -160.74 -177.42 6.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.954 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -84.2 144.38 29.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.029 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.5 139.27 55.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 105.11 -27.61 17.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.502 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.8 tp -64.08 -55.88 18.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -32.81 70.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.966 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.18 -30.49 68.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.851 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -39.22 21.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 10.1 mt -65.61 -34.58 71.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.999 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 8.4 mt -78.74 -31.47 46.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.786 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -72.5 -44.29 62.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -60.23 -49.39 77.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.856 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.44 31.23 20.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.906 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -85.12 151.12 24.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.91 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.52 144.14 80.31 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.13 -4.32 15.21 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.529 2.153 . . . . 0.0 112.673 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -56.86 -46.39 81.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.747 0.308 . . . . 0.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 p -109.29 31.67 5.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.167 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -99.99 164.55 11.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.18 174.19 11.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.834 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.8 -39.35 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.2 p -58.73 -41.02 85.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 19.8 tp -69.04 -31.24 69.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.879 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.21 -44.51 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.7 -43.73 92.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -67.98 -44.72 76.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.1 -39.84 86.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -60.44 -41.1 93.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.867 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.102 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.36 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.43 -38.04 71.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.809 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.53 -42.91 95.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 396' ' ' VAL . 24.3 t80 -62.37 -46.42 88.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 34.0 mt -65.53 -29.74 70.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.01 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -70.06 -29.62 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.936 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 35.9 mt -58.49 147.9 67.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.004 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.86 158.76 5.91 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.576 2.184 . . . . 0.0 112.224 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.53 -31.46 72.68 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.894 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -68.28 -35.1 77.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -75.44 -39.57 58.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.906 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -59.75 -42.17 92.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.53 81.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -42.04 90.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.87 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 29.6 mt -74.76 -29.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.203 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.446 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 5.9 m-85 -69.51 -46.59 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.887 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.83 -42.7 48.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.959 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.91 127.23 34.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -152.31 -46.87 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.875 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -97.1 -28.59 14.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.016 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.96 -0.33 38.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.556 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.95 -29.28 67.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.759 0.314 . . . . 0.0 110.909 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 83.3 p -59.0 114.46 2.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.894 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.56 -65.63 1.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.852 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -120.19 153.2 36.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -99.48 -35.55 9.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.167 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.082 179.978 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 4.6 m120 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.849 0.356 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 66.3 p -59.59 167.17 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.089 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -118.5 164.06 15.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t -95.63 98.92 8.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.025 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 18.1 m -94.95 -178.44 4.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.014 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -19.72 64.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.093 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -54.0 -27.9 34.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.214 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -39.32 75.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.123 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -76.63 -34.36 58.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.995 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -30.82 63.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.0 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -68.34 -46.61 69.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.28 -39.66 79.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.172 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -68.97 -39.02 79.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -74.46 -32.48 62.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.907 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -71.03 -47.85 56.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.59 -34.28 73.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -69.87 -31.71 69.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -44.05 17.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.95 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -68.79 -55.01 12.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.085 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.9 31.61 9.13 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 17.2 pt -109.86 164.02 6.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.81 0.338 . . . . 0.0 111.09 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 152.4 41.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -31.11 69.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.91 96.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.134 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.5 t -63.41 -51.9 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -61.68 -31.15 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.19 62.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.9 ttt85 -72.26 -42.44 65.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.942 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.4 m -78.03 -33.7 18.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.19 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.86 -72.24 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.11 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.438 ' CE1' ' CE ' ' A' ' 429' ' ' MET . 3.3 p90 -131.79 114.57 14.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.32 88.8 3.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.923 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -143.92 -74.62 0.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 36.9 p -148.7 171.02 16.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.0 -33.36 10.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.991 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.89 -27.47 72.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.623 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 33.3 tp -60.84 -46.02 92.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.032 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 5.7 tt -56.95 -32.09 65.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.062 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -29.69 40.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.86 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -31.87 59.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.031 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 8.0 mt -73.56 -45.08 52.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.091 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.16 -44.62 62.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.045 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -62.4 -30.72 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.983 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -82.5 -44.51 15.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 61.55 30.51 18.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -86.97 164.86 16.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.786 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -93.18 151.97 40.87 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.39 -22.2 29.53 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.598 2.199 . . . . 0.0 112.457 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -29.95 60.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.155 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 67.9 p -100.91 -31.0 11.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -60.37 171.15 1.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.05 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.18 171.76 13.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.91 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -59.77 -31.74 69.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 p -58.75 -45.88 88.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.55 -37.53 86.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.98 -31.81 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.782 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.25 -44.08 73.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.199 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -73.8 -43.6 58.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.65 -49.2 78.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.911 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -32.18 70.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.724 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.96 92.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.972 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' MET . . . . . 0.438 ' CE ' ' CE1' ' A' ' 398' ' ' PHE . 41.1 mtt -62.5 -42.11 99.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.54 -41.3 96.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.836 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -60.31 -52.61 64.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.938 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -59.23 -46.27 88.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.877 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.74 -31.54 72.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.891 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -71.16 -28.37 64.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.018 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 82.9 mt -57.1 153.06 26.33 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.971 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.87 146.87 27.11 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.606 2.204 . . . . 0.0 112.386 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -64.76 -34.01 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.886 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.66 75.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.108 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -51.1 17.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -58.92 -29.48 67.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -46.92 69.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.171 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -65.75 -29.34 69.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.067 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 11.2 mt -73.03 -36.78 51.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.87 0.367 . . . . 0.0 111.026 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -71.38 -31.67 67.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.917 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -79.25 -45.94 18.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.72 119.05 6.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.03 -43.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.017 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -98.46 178.7 4.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -89.42 7.37 36.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.379 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.84 29.22 3.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.715 0.293 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.97 106.21 17.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.815 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -143.93 -175.88 4.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -126.48 112.59 15.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.966 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -71.57 178.43 3.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.151 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.084 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.843 0.354 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 1.1 p -156.21 31.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.44 140.08 57.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 27.7 t -108.64 102.08 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 14.4 m -86.55 -174.96 5.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.954 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 63.4 p -71.88 -23.96 61.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.037 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.403 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.6 mt-10 -54.18 -27.2 32.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.139 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.3 tp -57.9 -40.95 78.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.138 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -73.93 -34.13 64.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.822 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -71.65 -33.07 68.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.403 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.9 m0 -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . 0.413 HG12 ' CE1' ' A' ' 393' ' ' PHE . 31.8 t -60.26 -47.6 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.066 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -40.85 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.803 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.25 -34.7 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.925 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.94 -41.92 73.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.3 mt -65.91 -44.41 85.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -39.5 89.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -67.17 -51.8 49.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.909 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -66.46 -62.17 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.078 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.52 28.42 7.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.502 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 10.4 pt -100.8 166.71 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 75.1 m -79.39 159.35 27.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -31.49 70.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -63.26 -38.93 93.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.148 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 27.5 t -75.7 -34.51 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.133 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.413 ' CE1' HG12 ' A' ' 379' ' ' VAL . 33.1 t80 -73.67 -43.17 60.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.946 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.85 -32.32 72.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -68.56 -55.4 11.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.42 -35.87 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.117 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -71.98 -69.15 0.41 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.205 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.7 p90 -139.68 110.68 6.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.969 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.6 93.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.66 -165.47 2.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.801 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.86 131.09 43.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -59.01 -32.23 69.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.082 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.65 -20.6 77.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.703 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.77 -48.02 76.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.8 tt -57.88 -36.65 72.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.065 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.8 p -67.15 -29.89 69.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -80.1 -35.83 36.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.956 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.2 mt -66.29 -37.1 78.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.058 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.13 -32.52 33.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -71.07 -49.58 43.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -73.57 -33.7 64.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.93 31.09 20.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.19 98.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.943 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.02 155.45 54.58 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.869 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.31 -19.25 65.46 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.656 2.237 . . . . 0.0 112.464 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -58.26 -29.53 65.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.02 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -133.91 19.15 3.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.489 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.68 146.43 23.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.133 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.48 179.04 0.65 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.907 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -66.7 -39.32 88.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.051 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -45.14 93.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.13 -33.02 73.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.802 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.53 -32.55 72.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -67.43 -51.1 55.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -63.44 -36.49 83.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.004 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.12 -38.81 79.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -63.32 -39.86 95.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.3 -38.72 92.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.112 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 3.1 ttm -67.97 -33.66 75.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.855 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -70.25 -39.92 74.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.81 -50.38 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.945 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -55.53 -41.39 73.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.2 mt -68.66 -28.78 67.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -82.48 -22.24 35.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.16 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 34.3 mt -53.93 148.79 19.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.096 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 152.13 16.2 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.578 2.185 . . . . 0.0 112.38 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.53 -36.21 81.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.856 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.06 85.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.34 -40.08 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.928 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.407 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 50.6 mtm-85 -59.45 -46.56 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -43.47 96.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.908 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -50.56 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.978 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.62 -30.65 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 16.4 m-85 -75.79 -40.79 54.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -75.34 -42.14 55.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -59.58 93.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -153.16 -49.95 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.953 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.53 122.19 18.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.804 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -77.95 -177.69 5.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -71.44 -65.57 0.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 121.76 15.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.1 mp -104.62 -54.39 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -126.25 86.35 2.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.919 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -66.63 112.8 4.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.099 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.067 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.88 0.371 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.46 143.74 49.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.077 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -87.81 130.24 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.896 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.99 123.07 49.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.1 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 69.3 m -90.57 166.38 13.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.912 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 6.2 m -59.38 -21.74 60.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.404 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.2 mt-10 -53.4 -27.78 26.01 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.189 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 5.8 tp -58.72 -45.02 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.105 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -66.23 -38.95 89.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -31.03 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.817 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.404 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 54.0 m0 -68.44 -42.14 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.04 -51.05 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.19 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -60.53 -48.94 79.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.57 -35.88 82.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -64.86 -47.03 79.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 393' ' ' PHE . 69.5 mt -60.91 -44.55 96.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.868 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -60.22 -31.58 70.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.003 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -85.41 -38.49 18.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.8 -55.62 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.056 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.09 52.16 3.53 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.419 HD12 ' CE1' ' A' ' 444' ' ' TYR . 22.7 pt -131.24 179.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.824 0.345 . . . . 0.0 111.153 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -89.88 154.49 19.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -31.09 69.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.23 94.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.158 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -71.89 -31.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.185 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.415 ' CD2' HD21 ' A' ' 383' ' ' LEU . 33.3 t80 -75.28 -43.96 48.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.003 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.98 78.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.112 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.91 -59.5 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.874 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.6 m -59.87 -39.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.013 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -66.13 -72.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.075 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.8 p90 -130.4 97.31 4.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.834 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -60.14 109.73 1.04 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.971 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -154.24 -70.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.4 170.65 8.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -97.12 131.56 43.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.8 -27.95 6.62 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.545 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.55 -45.8 85.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.2 tt -58.54 -41.74 86.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.014 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.5 m -64.41 -30.06 71.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -29.22 42.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.02 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.3 mt -80.37 -39.7 19.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 11.7 mt -76.99 -50.67 12.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.139 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -33.36 71.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.026 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -36.66 81.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 60.64 34.75 20.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -91.29 126.14 36.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -71.42 148.99 93.68 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.954 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.78 -8.39 22.99 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.579 2.186 . . . . 0.0 112.642 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -56.94 -39.42 74.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.793 0.33 . . . . 0.0 111.019 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 80.8 p -125.56 32.49 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.139 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.84 147.77 24.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.106 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 83.1 p -65.66 -178.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -72.74 -40.69 65.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 14.4 t -60.37 -43.02 96.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . 0.405 ' CD1' ' CD1' ' A' ' 426' ' ' LEU . 3.3 tm? -63.86 -40.98 97.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.18 -30.76 68.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.01 -40.2 78.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.037 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -63.25 -37.11 85.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.854 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . 0.405 ' CD1' ' CD1' ' A' ' 422' ' ' LEU . 13.9 mt -75.57 -32.04 60.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -54.1 43.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.896 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.5 86.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.5 mtm -68.17 -35.5 78.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.851 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -65.75 -41.14 92.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.874 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -60.6 -40.3 91.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -64.18 -32.71 74.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.945 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.76 -28.75 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -70.0 -29.53 66.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.982 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 3.7 mt -58.75 151.54 52.68 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 156.76 6.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.546 2.164 . . . . 0.0 112.317 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -66.05 -37.75 86.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.943 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.89 71.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.077 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.92 -38.25 64.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.925 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 36.9 mtm-85 -59.59 -47.23 86.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.816 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.41 -37.46 85.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.84 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -37.14 86.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 8.5 mt -79.16 -40.83 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.014 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.419 ' CE1' HD12 ' A' ' 388' ' ' ILE . 15.8 m-85 -60.84 -43.17 98.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.841 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -29.66 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.913 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.16 -174.32 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.13 -165.96 2.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -96.52 137.04 36.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -60.85 -34.86 75.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.068 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.01 38.59 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.982 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.35 -39.84 18.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.4 mt -72.99 170.42 14.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.023 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.53 156.48 18.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -63.92 176.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.023 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.052 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.883 0.373 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 13.1 p -90.97 140.58 29.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.157 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -102.87 178.61 4.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.8 137.9 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 3.1 m -97.98 178.77 5.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.98 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.7 t -69.01 -21.14 64.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.118 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.74 -27.95 20.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.089 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.2 tp -58.38 -40.28 77.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -74.79 -37.26 62.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.83 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -31.37 70.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 53.0 m0 -70.7 -42.05 71.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 28.0 t -61.8 -48.29 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -49.6 65.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.901 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.75 -45.4 92.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.09 -41.12 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 5.8 mt -60.21 -31.51 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.962 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.37 -49.75 12.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 3.1 mtt-85 -62.66 -36.78 83.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -79.49 -30.53 42.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 65.5 66.96 2.2 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.482 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 16.4 pt -143.78 173.43 5.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.809 0.337 . . . . 0.0 111.196 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.3 m -91.75 154.04 19.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.945 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -60.12 -30.24 69.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.896 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.31 -41.43 89.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.156 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.6 t -75.57 -51.95 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.38 -29.28 63.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -71.02 -46.36 62.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.2 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.04 -48.69 80.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.415 HG23 ' CZ ' ' A' ' 432' ' ' PHE . 21.9 m -67.42 -27.99 40.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.208 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -85.06 -76.11 0.33 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.21 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.415 ' CE1' ' HE2' ' A' ' 429' ' ' MET . 16.3 p90 -125.53 118.48 25.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -74.29 107.71 6.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.841 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -154.17 -70.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.8 t -169.99 139.18 1.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -72.73 73.4 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.926 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -179.31 -37.51 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.9 tp -61.55 -29.07 69.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.49 -37.1 72.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.968 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 89.1 p -72.71 -40.33 66.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.866 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.23 -42.13 99.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.821 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 10.6 mt -67.88 -35.09 70.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 28.6 mt -76.21 -34.36 59.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -68.86 -41.7 78.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -60.44 -33.46 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 44.01 31.84 0.56 Allowed 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.406 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 135.34 33.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -67.2 144.7 98.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.57 -0.66 10.92 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.538 2.159 . . . . 0.0 112.704 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -65.56 -37.02 85.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.987 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.1 p -123.56 25.93 8.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.269 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.03 174.9 5.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.119 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 70.2 m -69.76 171.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.819 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.42 -32.01 62.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 16.7 m -61.17 -41.14 96.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 52.3 tp -69.11 -41.26 77.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.977 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.94 -31.68 70.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 25.7 t -71.35 -47.63 58.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -64.56 -35.59 81.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.864 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.1 -41.36 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.894 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -39.32 86.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.02 -44.12 97.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' MET . . . . . 0.415 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 2.9 mtt -63.26 -33.26 75.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.944 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -67.48 -42.39 83.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.15 -47.2 86.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.79 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . 0.415 ' CZ ' HG23 ' A' ' 396' ' ' VAL . 32.5 t80 -62.25 -31.15 71.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 18.0 mt -84.59 -23.19 29.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.116 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -31.22 68.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.925 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.98 154.88 85.46 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.74 156.14 59.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.482 2.121 . . . . 0.0 112.237 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -58.68 -30.96 67.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.942 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.37 94.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -73.72 -37.15 65.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -59.79 -47.44 85.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.11 -41.35 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 5.2 mt -70.53 -32.95 51.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.134 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -68.15 -39.64 82.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -75.36 -44.97 42.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.43 115.86 3.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.938 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -162.06 143.9 11.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -83.23 115.41 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.894 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.27 -26.77 63.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 51.28 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.991 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.02 37.05 1.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.7 143.38 55.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -131.72 -59.08 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -79.99 92.65 5.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.207 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.131 -179.951 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.819 0.342 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 1.3 m -111.9 166.46 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.142 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -60.46 156.46 16.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -98.7 109.61 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.158 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 10.7 m -85.25 -177.07 6.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.785 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -25.88 61.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.421 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.8 mm-40 -54.79 -25.21 26.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 1.1 tp -56.99 -42.95 80.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.131 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -72.63 -42.36 64.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.82 -31.31 72.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.826 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.421 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 35.6 m0 -67.46 -40.01 85.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -57.9 -59.44 3.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.11 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 45.1 mtt-85 -54.16 -34.91 61.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.99 -30.31 58.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -78.35 -36.17 46.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.429 HD23 ' CG ' ' A' ' 393' ' ' PHE . 4.1 mm? -67.54 -44.39 78.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 52.2 tttt -69.76 -45.97 66.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.892 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.61 -54.84 41.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.94 -30.83 69.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.132 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 71.84 40.21 58.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.449 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 29.0 pt -125.37 176.86 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.162 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 95.1 p -91.61 155.42 18.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.989 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -59.19 -27.98 66.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.24 82.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.6 t -72.53 -31.32 37.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.429 ' CG ' HD23 ' A' ' 383' ' ' LEU . 71.6 t80 -73.39 -48.02 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.43 -36.99 76.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -67.35 -62.4 1.44 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.416 HG23 ' CE2' ' A' ' 432' ' ' PHE . 30.7 m -59.52 -29.45 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.168 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -75.26 -58.77 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.993 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -148.27 119.21 7.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.33 99.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -169.39 -168.07 0.77 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.736 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.47 149.36 33.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.053 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.91 -31.6 71.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -66.92 -25.86 73.19 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.553 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.31 -50.36 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 0.0 111.005 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.51 -38.35 77.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.052 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.3 p -68.6 -30.82 69.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.74 -31.41 52.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.996 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 9.9 mt -80.35 -30.81 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.987 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.01 -34.62 43.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.832 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -67.79 -36.9 81.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 19.3 mmtm -60.12 -53.4 58.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 60.28 30.85 20.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -99.86 146.55 26.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.41 139.8 87.08 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.787 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -83.06 50.52 3.37 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.732 2.288 . . . . 0.0 112.606 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -100.05 -40.71 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.891 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.2 p -124.36 30.68 5.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.043 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.8 -169.62 2.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.116 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 57.8 m -90.17 172.27 8.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.04 -31.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 92.3 p -59.62 -43.58 93.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.848 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 13.1 tp -68.21 -34.86 77.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.853 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.64 -39.56 84.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.85 -44.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -64.92 -52.63 55.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.93 -31.26 69.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -44.27 70.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.48 -45.8 82.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.1 mtp -59.85 -34.24 72.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -68.77 -32.4 72.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.49 -34.34 75.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.819 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . 0.416 ' CE2' HG23 ' A' ' 396' ' ' VAL . 19.5 t80 -69.44 -35.58 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.5 mt -79.58 -30.77 41.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -72.79 -27.92 62.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.009 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.32 147.49 57.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.014 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.98 155.92 10.49 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.593 2.195 . . . . 0.0 112.249 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -66.23 -31.75 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.18 77.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.074 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -76.1 -40.17 53.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.864 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.403 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 62.2 mtm180 -70.86 -25.62 62.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.106 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.01 -49.5 50.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.062 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -41.91 99.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.094 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 15.8 mt -61.68 -50.17 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.994 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.403 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 12.5 m-85 -61.32 -30.97 70.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.938 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -79.5 -60.76 2.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.839 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.72 108.79 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.86 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.27 -49.82 2.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.883 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 130.57 38.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.946 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.91 -165.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -57.12 -46.79 82.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 86.5 p -75.4 -174.33 2.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.841 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.41 36.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -101.2 103.64 14.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.953 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -72.57 144.52 47.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.118 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.091 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.1 m120 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.816 0.341 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 59.75 160.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.113 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -129.92 153.42 48.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 29.0 t -70.12 102.57 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.984 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -70.12 169.22 13.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -16.71 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.217 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.418 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.1 mp0 -51.36 -28.15 11.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.762 0.315 . . . . 0.0 111.183 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 2.0 tp -58.51 -37.78 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.0 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -73.51 -42.95 61.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.882 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.78 -32.17 73.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.99 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.418 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.9 m0 -66.28 -41.9 89.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.921 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 32.5 t -61.15 -35.35 65.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.007 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.19 -31.39 65.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -73.8 -37.92 64.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.2 -37.84 57.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.944 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.34 -31.2 71.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.907 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -86.65 -31.26 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.79 -67.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.29 -41.94 90.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.13 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 74.18 70.88 1.18 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.488 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.417 HD11 ' CD1' ' A' ' 444' ' ' TYR . 21.1 pt -134.11 158.0 42.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.055 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.17 160.9 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -66.19 -31.43 72.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.59 69.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.212 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.5 t -84.01 -59.54 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.275 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -58.02 -26.84 62.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -81.05 -40.51 24.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.27 -39.64 59.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.169 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.417 ' HB ' ' CZ ' ' A' ' 432' ' ' PHE . 27.4 m -71.61 -32.05 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.224 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -81.22 -66.51 0.88 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.401 ' CE2' ' OD1' ' A' ' 425' ' ' ASN . 16.5 p90 -128.36 114.85 17.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -59.59 109.08 0.82 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -169.57 -172.38 1.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -69.84 132.13 45.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.139 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -63.93 154.61 33.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 95.01 -24.5 28.33 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -58.97 -41.11 86.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.791 0.329 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 2.2 tp -57.38 -33.77 68.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 8.0 t -65.41 -43.74 89.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.932 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -69.08 -41.92 76.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.008 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 25.7 mt -62.58 -40.49 88.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.013 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 58.7 mt -72.18 -37.01 69.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.021 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -44.02 73.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mmmt -58.82 -39.53 81.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.013 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 59.62 30.73 20.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -93.52 109.13 20.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.29 167.6 6.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 -9.97 27.38 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.505 2.137 . . . . 0.0 112.657 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -30.04 46.23 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.02 32.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.144 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -92.74 177.0 6.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.043 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 5.3 m -89.3 173.42 8.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -41.73 97.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.934 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 57.9 m -60.82 -41.71 96.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.873 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.43 -42.47 96.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.847 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 25.7 mt -59.86 -42.24 93.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 28.0 t -62.37 -30.45 49.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.097 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . 0.401 ' OD1' ' CE2' ' A' ' 398' ' ' PHE . 1.9 m-80 -70.95 -44.88 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 28.7 mt -67.39 -44.25 79.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 11.3 mtt180 -59.88 -40.17 87.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -71.57 -34.62 70.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.3 mtt -73.35 -33.84 65.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.883 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -66.15 -46.71 76.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -64.75 -38.37 90.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . 0.417 ' CZ ' ' HB ' ' A' ' 396' ' ' VAL . 56.8 t80 -71.17 -34.45 70.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.0 mt -75.53 -30.68 59.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -72.65 -27.4 62.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.64 157.44 10.1 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.067 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.86 147.35 32.74 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.618 2.212 . . . . 0.0 112.331 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -63.98 -42.29 97.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.959 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.08 -31.66 70.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.65 -42.46 58.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -60.12 -45.19 93.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -62.23 -38.63 89.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.804 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -37.99 82.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 19.8 mt -73.65 -35.85 45.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.036 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.417 ' CD1' HD11 ' A' ' 388' ' ' ILE . 22.2 m-85 -67.14 -41.07 86.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -84.52 -16.92 40.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.283 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.76 -66.93 0.3 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 61.96 116.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -98.97 134.56 41.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.04 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.35 174.11 0.77 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.816 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.4 60.15 1.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.837 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 19.9 m -91.19 115.47 28.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.855 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.51 170.95 8.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -113.73 171.1 7.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.915 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -69.16 110.28 4.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.071 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.134 -179.96 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.887 0.375 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.7 p -130.26 106.17 8.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.99 40.21 3.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.949 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.22 111.36 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.163 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 39.7 m -100.02 173.65 6.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.791 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 21.5 t -58.63 -25.42 62.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -55.6 -24.74 34.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.138 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 6.0 tp -57.46 -42.54 81.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.116 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.97 -47.48 45.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.905 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.95 -28.57 66.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.042 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 41.5 m0 -68.17 -56.27 9.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.924 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . 0.418 HG11 ' CE1' ' A' ' 393' ' ' PHE . 22.3 t -58.65 -47.21 89.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -58.37 -38.72 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.66 -41.45 31.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.51 -40.2 95.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.894 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.24 -56.71 17.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.49 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -69.51 -33.01 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -86.51 -30.68 21.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 70.49 28.43 71.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.57 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 36.3 pt -106.87 164.32 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 151.86 36.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.984 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -60.78 -31.04 70.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.01 -40.21 94.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.8 t -73.65 -32.05 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.089 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.418 ' CE1' HG11 ' A' ' 379' ' ' VAL . 18.2 t80 -75.87 -51.26 12.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.62 -31.15 69.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.146 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -70.13 -43.09 71.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.932 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.01 -32.4 12.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.19 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.18 -65.8 0.76 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.193 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -135.78 106.63 6.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -70.28 95.14 0.98 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.87 -71.37 0.46 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.12 131.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.152 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.48 125.95 25.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.93 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.54 -27.69 6.8 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.507 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.3 tp -63.16 -33.17 74.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.861 0.362 . . . . 0.0 111.036 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 3.4 tt -58.57 -43.3 89.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 59.8 p -67.3 -29.66 69.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.21 -44.25 38.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 12.7 mt -67.92 -33.55 61.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.156 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.95 -30.51 56.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.944 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 -67.62 -37.15 82.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -68.47 -50.9 48.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.96 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 61.24 31.58 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -95.68 129.92 42.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.834 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.89 165.6 9.62 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.65 -8.97 24.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.614 2.209 . . . . 0.0 112.613 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -56.34 -40.66 74.82 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 t -110.74 -21.6 12.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.369 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -58.25 148.06 28.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.912 0.387 . . . . 0.0 111.109 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 33.9 m -76.89 -178.06 4.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.935 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -63.72 -30.45 71.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.923 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.9 m -57.4 -50.95 71.36 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.029 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.29 -40.19 95.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 96.3 mt -58.34 -31.99 68.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 33.0 t -74.07 -32.37 32.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.976 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -74.78 -40.96 60.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.68 -40.76 92.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -59.99 -41.17 91.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.814 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.91 94.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -38.83 73.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.9 -45.17 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.72 -39.58 80.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.878 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -70.41 -35.73 73.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.5 mt -81.3 -30.93 33.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -70.03 -29.13 66.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.903 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.19 152.53 40.99 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.917 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.03 148.47 23.61 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.524 2.149 . . . . 0.0 112.32 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -60.97 -32.85 72.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.03 -38.08 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.047 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -69.95 -40.2 75.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -60.15 -40.45 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -63.73 -37.23 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.01 -41.29 77.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 13.5 mt -69.43 -38.46 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.081 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -67.06 -33.57 75.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.936 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.47 -19.27 23.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.88 115.03 1.63 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.149 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -116.0 -50.75 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.839 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -79.03 127.26 31.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.81 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -86.99 6.39 32.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.455 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -82.52 -17.52 44.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.68 0.276 . . . . 0.0 111.163 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 74.0 m -54.43 -71.43 0.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 111.049 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 5.2 tp -160.86 90.17 0.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -164.65 121.97 1.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -64.82 145.87 55.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.117 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.078 179.954 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.835 0.35 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.0 t -142.86 121.73 12.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.155 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.66 149.21 22.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.78 143.0 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 2.9 m -100.16 168.11 10.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -22.86 64.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.422 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 84.2 mt-10 -53.74 -26.61 24.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.211 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.27 -44.84 84.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.196 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -73.22 -34.24 65.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -30.31 65.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.422 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 40.7 m0 -71.41 -37.8 71.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.979 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . 0.416 HG13 ' CZ ' ' A' ' 393' ' ' PHE . 21.5 t -64.72 -39.78 86.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.198 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 19.5 mtt-85 -67.97 -55.68 11.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -59.45 -30.66 68.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -78.83 -30.77 45.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.013 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 8.7 mt -68.5 -58.36 4.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -41.19 88.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.908 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -64.65 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.95 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.34 -52.32 65.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.067 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.36 69.29 1.36 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.413 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.445 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 33.9 pt -138.02 176.14 7.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 111.124 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 m -90.57 153.84 20.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.02 -30.94 69.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.88 90.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.093 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 29.8 t -74.66 -35.32 37.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.176 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.416 ' CZ ' HG13 ' A' ' 379' ' ' VAL . 42.9 t80 -72.06 -25.97 61.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.091 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.42 -55.5 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.348 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -58.38 -46.93 85.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.059 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.417 HG21 ' CZ ' ' A' ' 432' ' ' PHE . 27.3 m -63.22 -33.07 58.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -84.74 -70.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.444 ' CE2' ' HG2' ' A' ' 400' ' ' ARG . 2.0 p90 -143.05 112.85 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.94 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -58.62 124.77 20.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . 0.444 ' HG2' ' CE2' ' A' ' 398' ' ' PHE . 0.0 OUTLIER -170.1 -172.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.91 113.94 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.109 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.29 131.4 10.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.374 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.36 -14.36 10.93 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.784 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.0 tp -79.76 -43.03 23.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.746 0.307 . . . . 0.0 111.04 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 9.2 tt -55.39 -28.38 53.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.21 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 24.9 p -70.95 -50.3 36.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.066 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.29 -41.38 94.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 28.4 mt -59.88 -44.62 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 7.4 mt -75.52 -30.61 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -47.6 65.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.895 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -66.89 -41.63 86.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 61.24 31.61 19.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.2 137.85 53.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -75.44 149.6 84.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.833 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.69 -5.74 17.56 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.552 2.168 . . . . 0.0 112.683 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -66.27 -57.59 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.774 0.321 . . . . 0.0 111.064 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 76.4 p -108.67 34.32 3.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.215 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 -177.26 3.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.3 174.61 8.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.979 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -71.66 -31.73 67.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.11 -39.23 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.94 -33.99 72.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 29.1 t -73.91 -38.14 49.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.071 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -69.28 -50.14 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.938 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 75.0 mt -57.63 -32.01 66.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.981 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -63.8 -45.56 89.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.25 -43.28 74.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.137 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -35.33 75.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -69.74 -44.27 70.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -64.4 -35.3 80.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.933 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . 0.417 ' CZ ' HG21 ' A' ' 396' ' ' VAL . 64.1 t80 -69.77 -33.19 72.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 11.7 mt -84.66 -30.46 24.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.876 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -70.85 -29.06 65.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.915 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 28.9 mt -57.79 158.72 11.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.31 165.47 30.35 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.639 2.226 . . . . 0.0 112.296 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.21 -33.14 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -34.95 74.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.74 -52.14 12.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.965 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.405 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 46.9 mtm180 -59.46 -30.54 68.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.996 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.71 -34.74 69.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.996 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -77.1 -31.55 56.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 7.0 mt -75.71 -40.51 40.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.053 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.445 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 13.0 m-85 -68.04 -29.48 68.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -84.71 -54.64 4.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.07 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.61 -178.03 6.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.045 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -162.52 -171.68 2.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.827 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.12 -56.41 2.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.895 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.82 -170.68 1.68 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.889 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -74.51 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.879 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.0 m -83.14 -175.91 6.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.858 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.6 171.17 7.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -134.01 23.86 3.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -100.09 76.39 1.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.098 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.199 179.899 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 9.0 p30 . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.764 0.316 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 13.1 p -64.83 -58.33 6.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.164 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -101.41 170.76 8.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.3 89.07 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.138 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.4 m -64.82 158.27 25.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.017 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.4 m -63.05 -21.41 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.11 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.4 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.6 mt-10 -53.03 -26.5 15.87 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.13 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 6.5 tp -57.85 -42.62 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 111.132 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . 0.45 ' CZ ' ' CD2' ' A' ' 426' ' ' LEU . 99.2 m-85 -70.47 -44.29 68.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -65.63 -31.34 72.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.947 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.4 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 45.6 m0 -70.57 -34.79 72.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.74 -37.73 80.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.031 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.8 -38.64 64.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.935 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -73.63 -34.67 65.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.949 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.9 -47.74 50.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.87 -30.88 69.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.987 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -81.68 -39.16 24.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -72.81 -32.27 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -76.5 -67.72 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 106.54 58.68 0.6 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.467 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 31.8 pt -141.53 -179.71 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 0.0 111.072 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.41 154.81 17.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.786 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -29.72 67.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.76 -47.35 86.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.161 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -51.64 49.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.15 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -58.41 -45.45 88.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -63.07 -30.08 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.185 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -51.38 12.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.943 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.51 -36.78 77.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.201 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -68.73 -58.34 4.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -150.81 111.05 4.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.097 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -75.22 119.65 19.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.59 -65.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.848 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.6 t -161.46 146.7 13.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.087 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -80.08 147.85 31.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 77.1 3.79 82.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.79 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 12.5 tp -88.31 -29.57 20.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.87 0.366 . . . . 0.0 110.93 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.66 -20.9 66.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.164 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 85.3 p -68.42 -64.93 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.202 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -53.43 -40.07 64.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.242 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.88 -33.2 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.338 . . . . 0.0 110.959 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.2 mt -91.23 -30.52 16.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.876 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 15.7 ttp85 -72.67 -40.21 66.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.22 -41.31 92.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.874 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 61.09 31.75 19.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.99 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -78.72 142.61 36.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -85.36 142.58 37.97 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.4 -25.66 25.41 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.528 2.152 . . . . 0.0 112.43 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -57.43 -47.25 82.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.01 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.7 p -110.42 28.75 8.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.205 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.13 -178.71 3.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.125 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 74.7 m -99.94 172.48 7.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -62.25 -34.0 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.941 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.27 -46.03 85.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 7.3 tp -65.36 -40.67 93.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.909 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 31.2 mt -59.65 -35.91 75.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.817 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 30.5 t -78.12 -37.19 22.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.853 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -60.69 -48.48 81.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.79 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . 0.45 ' CD2' ' CZ ' ' A' ' 376' ' ' TYR . 3.6 mt -65.12 -37.48 87.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.761 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.93 -41.95 97.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.96 92.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.018 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.0 mtm -60.67 -34.22 74.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.798 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -64.43 -45.76 86.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.743 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.36 -48.81 80.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.852 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -60.63 -31.35 70.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.832 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.34 -28.61 26.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.941 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -69.94 -34.88 74.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.21 146.89 82.54 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.64 152.4 16.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.47 2.113 . . . . 0.0 112.329 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -31.1 69.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.11 93.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.018 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.16 -40.79 74.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.85 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 28.7 mtm-85 -61.87 -38.94 90.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.828 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -66.87 -38.72 86.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -35.41 78.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.863 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 7.5 mt -81.68 -35.37 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.09 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.21 -34.7 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.939 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -62.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.941 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -64.12 121.07 13.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -111.46 168.0 9.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.908 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.91 14.63 20.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.301 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -76.57 -39.53 52.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 0.0 111.021 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -97.8 30.76 2.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.874 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.0 p -85.19 -43.52 13.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.2 30.67 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -92.27 -59.85 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -62.79 -31.09 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.103 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.097 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.822 0.344 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.1 t -99.22 98.36 9.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -88.41 129.65 35.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.51 124.23 70.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.077 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.8 m -86.52 170.25 12.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -21.74 63.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.414 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 2.5 mp0 -52.15 -28.1 16.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.216 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 7.6 tp -58.81 -41.54 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.066 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -71.09 -36.44 72.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -69.31 -36.21 76.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.414 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.0 m0 -63.24 -40.48 97.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 26.2 t -58.67 -52.58 58.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -60.08 -40.6 90.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.02 -36.51 80.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.02 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.17 -46.61 61.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.03 -35.22 74.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.88 -51.28 9.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.892 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -63.72 -52.24 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.931 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.5 8.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 94.64 59.06 1.15 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.476 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 33.7 pt -138.54 165.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.334 . . . . 0.0 111.089 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.75 157.95 31.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -30.69 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.929 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.93 -36.29 76.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.287 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.49 -52.53 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.141 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -57.02 -30.89 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.68 -29.36 29.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.104 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -73.6 -46.7 45.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.958 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.56 -38.1 75.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.17 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -69.15 -57.71 5.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -153.59 105.59 2.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.845 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -73.65 97.25 2.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 23.8 mtt85 -146.21 -65.35 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.831 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 26.3 m -154.16 117.65 4.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.075 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -60.88 -23.08 64.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.209 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -91.17 17.45 55.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.875 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -100.02 -37.85 8.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.317 . . . . 0.0 110.908 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 1.6 tp -57.92 -42.77 85.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.977 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 3.3 t -64.78 -29.51 70.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.031 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -80.15 -43.15 22.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 10.6 mt -67.97 -42.73 85.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.052 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 25.5 mt -66.57 -33.6 76.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.67 -38.31 73.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -65.9 -49.88 66.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.18 31.05 20.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.919 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.63 135.58 38.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -70.49 127.73 91.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.861 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.73 54.06 5.06 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.511 2.14 . . . . 0.0 112.478 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -100.03 -43.57 6.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.805 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.0 p -128.46 31.32 5.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.094 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.34 -178.31 6.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.3 p -77.27 175.05 10.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -76.63 -31.44 57.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.932 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 3.2 t -59.46 -39.8 84.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.23 -40.8 64.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.72 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.845 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 30.4 t -60.43 -46.98 94.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.991 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -63.82 -46.42 85.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.76 -33.68 75.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.836 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -41.42 99.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.15 -49.73 76.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.994 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 6.4 ttm -66.13 -37.64 86.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -45.82 88.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -61.84 -36.74 82.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -68.91 -39.36 79.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.798 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.21 -32.38 49.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -71.04 -30.71 66.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 9.8 mt -58.92 159.5 13.34 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.4 147.83 90.73 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.549 2.166 . . . . 0.0 112.293 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.17 -29.98 67.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.15 -42.71 86.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.094 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.16 -42.42 65.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 41.6 mtm-85 -59.1 -42.22 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.68 -42.37 96.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.873 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -62.44 -50.05 73.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 5.6 mt -60.01 -42.62 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -65.65 -31.92 73.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -85.55 -3.92 59.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.407 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -97.5 30.67 2.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.791 0.329 . . . . 0.0 111.094 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -83.99 126.27 32.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.907 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -64.41 81.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.99 -169.76 1.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.972 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.54 -24.59 53.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.088 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 10.8 t -55.26 121.29 8.55 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.09 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.0 tt -138.05 130.24 28.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -120.24 103.71 9.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -90.97 -64.06 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.126 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.114 -179.956 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.852 0.358 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.72 96.28 10.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.172 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.35 107.18 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 24.2 t -81.12 122.13 35.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.003 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 13.0 m -99.62 169.38 9.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.905 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 79.6 p -63.5 -21.75 66.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.116 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.418 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 9.2 mm-40 -51.86 -27.16 11.76 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 111.211 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.1 tp -57.93 -44.88 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.167 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.11 -43.6 82.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -67.61 -30.37 69.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.951 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.418 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 39.2 m0 -68.15 -42.05 80.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.948 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.3 t -59.53 -43.93 91.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -60.69 -57.19 13.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -46.36 89.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.29 -33.41 67.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.049 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.1 mt -71.14 -30.56 66.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.74 -35.0 24.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.53 -31.71 57.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.41 -44.95 15.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 73.92 63.98 2.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.447 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 41.4 pt -139.52 167.22 20.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.103 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 151.26 30.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.29 -31.77 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.828 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.47 -39.5 91.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.131 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 24.8 t -75.86 -42.35 39.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.099 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -60.43 -50.46 73.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.64 -31.56 72.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -62.38 1.71 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -62.93 -37.06 78.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.64 -63.78 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.127 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -152.03 109.48 3.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.13 94.37 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.793 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -141.92 -70.11 0.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.793 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -157.41 165.14 36.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.02 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -88.65 -25.16 22.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.069 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -84.48 -26.03 40.78 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.628 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 26.3 tp -58.59 -45.39 89.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.08 -38.29 82.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 21.4 p -69.82 -31.1 68.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.936 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.26 -40.36 64.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 11.4 mt -72.09 -47.59 53.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.35 -35.79 81.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.3 -42.37 65.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -48.78 80.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 60.27 32.93 20.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.97 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -91.07 126.6 36.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.922 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.66 151.36 71.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.7 46.49 2.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.769 2.313 . . . . 0.0 112.638 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -100.18 -34.06 10.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.748 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.4 31.15 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.42 -174.85 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 94.6 p -99.77 179.26 4.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.97 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -62.18 -52.27 64.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.041 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 2.7 t -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.936 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -69.91 -33.9 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.69 -40.42 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.832 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.62 -48.98 85.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.142 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.54 -42.55 91.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.959 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 5.9 mp -65.05 -32.4 74.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.0 ttm105 -65.61 -40.72 92.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.46 73.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.163 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 26.7 mtm -60.97 -34.27 74.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -70.53 -50.81 33.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.924 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.59 -35.1 75.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.33 -31.67 62.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 21.3 mt -82.29 -31.32 30.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -79.23 -26.34 42.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 8.9 mt -55.88 159.66 5.21 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.055 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -51.7 141.74 43.09 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.59 2.193 . . . . 0.0 112.435 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.75 -39.75 95.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.98 -32.38 73.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.49 -40.47 66.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.824 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.419 ' HB3' ' CE2' ' A' ' 444' ' ' TYR . 87.5 mtm-85 -59.63 -41.05 89.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.47 -45.64 93.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -60.92 -41.8 96.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.45 -34.36 52.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.033 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 440' ' ' ARG . 10.9 m-85 -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.988 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -89.59 -52.76 4.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.78 101.53 0.27 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -118.48 -170.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.814 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -78.26 118.77 20.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.13 174.58 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -53.59 5.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.05 103.07 14.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.886 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.94 64.72 6.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.8 -73.62 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.88 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -64.05 126.4 27.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.076 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.894 0.378 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.9 m 59.06 31.09 21.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.238 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -128.95 121.22 27.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.87 112.38 5.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 19.4 m -84.18 175.06 9.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.6 t -58.6 -21.57 53.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.202 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.7 mt-10 -52.55 -26.19 12.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.208 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.0 tp -56.98 -44.36 82.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.133 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -69.72 -43.73 71.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.797 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -65.45 -31.51 72.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.411 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 36.0 m0 -65.49 -45.05 85.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.8 -38.67 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.103 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -67.83 -49.15 63.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -31.56 72.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.992 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -77.38 -31.3 54.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.986 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.89 -33.0 67.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.57 -34.39 35.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.872 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -78.53 -32.12 47.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -83.61 -56.75 3.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.94 52.47 2.24 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 4.0 pt -137.65 162.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.32 . . . . 0.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 19.7 m -74.53 150.46 39.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -60.19 -28.9 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.927 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.94 -46.4 85.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.223 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 28.8 t -69.92 -41.67 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -59.96 -36.58 77.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.015 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.7 -40.9 88.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -62.98 -51.8 65.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.19 -31.11 50.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.119 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.35 -76.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -126.93 117.99 23.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.71 95.5 6.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.788 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -145.18 -65.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.91 156.98 43.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.031 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -90.3 -32.85 16.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.06 26.79 19.27 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.522 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -99.98 -46.42 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.96 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 3.9 tt -57.89 -34.8 70.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.019 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.36 -30.88 67.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -79.42 -38.87 33.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.994 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.2 mt -63.68 -51.05 75.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.032 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.9 -38.96 83.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.85 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -37.39 83.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -63.63 -47.73 80.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 60.53 32.01 20.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.952 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.39 149.91 20.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.32 148.59 93.71 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.981 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -74.42 -5.74 17.34 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.198 . . . . 0.0 112.602 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.61 -30.99 68.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.087 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.3 t -127.02 21.07 6.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.39 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.98 171.0 15.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 32.9 t -74.16 172.54 11.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -72.72 -30.42 64.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 52.1 p -67.94 -42.4 81.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.856 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 1.1 tt -67.67 -40.75 84.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.77 -32.71 67.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 33.5 t -72.64 -35.4 50.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.984 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.77 -43.59 68.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 11.3 mt -60.07 -33.57 72.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -62.25 -56.29 20.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.86 -32.48 73.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 12.0 mtm -71.57 -36.57 70.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -66.74 -44.62 81.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.945 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -60.07 -46.01 90.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -58.14 -41.26 83.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.8 mt -71.49 -27.91 63.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.002 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -80.47 -25.03 39.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.166 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 48.9 mt -55.36 154.14 12.28 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.014 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.34 145.59 35.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.568 2.179 . . . . 0.0 112.328 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -63.74 -35.04 79.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.66 -37.89 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -75.22 -42.0 56.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -59.27 -40.33 85.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.09 -42.74 96.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -47.56 80.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 31.3 mt -59.55 -34.43 54.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.949 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.02 -43.25 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.723 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -100.08 25.09 7.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.975 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.78 102.53 0.35 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -147.7 140.35 24.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.952 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 117.98 12.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -37.24 62.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.949 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -100.12 44.76 1.01 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.48 101.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.966 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -143.06 -48.7 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -72.99 120.47 18.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -68.01 -32.07 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.066 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.017 -179.941 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.818 0.342 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 3.1 m -91.36 96.38 10.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.127 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -95.57 86.6 4.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.872 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.2 t -92.66 80.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.102 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.2 m -100.01 -174.38 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.4 t -58.15 -23.44 55.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.092 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.416 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 5.2 mm-40 -55.52 -28.66 56.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.083 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 2.1 tp -59.19 -32.58 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.92 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -77.86 -42.86 32.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.94 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -32.73 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.944 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.416 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.1 m0 -69.03 -44.92 71.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.012 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 37.0 t -61.42 -40.86 87.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.06 -30.77 61.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -45.75 48.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.962 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.36 -35.93 82.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.54 -32.91 74.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -79.54 -44.24 21.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -33.97 75.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.32 -69.1 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.071 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.32 61.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.434 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 23.8 pt -137.5 164.67 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 0.0 111.116 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 p -72.32 152.43 42.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -62.42 -31.11 71.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.27 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.4 t -79.73 -40.9 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -68.21 -50.33 54.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.74 -37.55 82.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 22.2 ttt-85 -60.63 -41.22 94.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.832 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 26.9 m -85.89 -30.4 6.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.84 -65.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . 0.416 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 3.8 p90 -143.47 102.62 3.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -68.61 97.49 0.8 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.829 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -142.07 -70.67 0.34 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.32 143.53 16.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.061 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -77.64 125.78 29.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.974 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 112.05 -28.47 9.26 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.428 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.03 -31.4 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . 0.403 HD13 ' CE1' ' A' ' 398' ' ' PHE . 5.8 tt -59.21 -47.47 85.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -31.41 72.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.903 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -68.45 -39.57 81.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.988 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 6.6 mt -64.96 -35.7 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.031 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.62 -35.16 45.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.925 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -71.33 -42.89 67.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 60.29 34.3 20.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.975 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.38 142.83 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.11 149.71 89.67 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.99 -11.37 29.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.571 2.18 . . . . 0.0 112.585 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -68.62 -38.89 80.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.361 . . . . 0.0 110.966 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -99.78 -26.87 13.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -55.58 176.38 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.243 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 43.4 t -82.76 175.93 9.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.05 67.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.856 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 m -58.84 -46.6 87.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.828 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 11.5 tp -65.03 -38.91 92.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.83 -31.2 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.815 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 30.6 t -74.11 -47.38 42.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.065 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -63.75 -42.46 97.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.13 -35.16 74.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -63.51 -39.15 93.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.03 89.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.54 -36.84 79.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -66.34 -46.94 75.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -60.63 -52.94 62.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.46 -40.62 78.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.987 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.32 -26.42 61.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -72.82 -28.2 62.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.87 149.24 55.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.924 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.7 161.49 4.4 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.602 2.201 . . . . 0.0 112.34 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.39 -31.51 72.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.08 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -71.01 -42.83 69.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.409 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 78.1 mtm-85 -64.56 -42.87 95.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.07 -34.44 78.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -67.35 -47.4 70.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.837 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.57 -47.26 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 21.2 m-85 -60.77 -34.2 74.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.862 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.83 8.72 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.311 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.06 113.47 22.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.841 0.353 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.25 -61.51 1.93 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.1 mtm-85 -89.86 129.89 36.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.53 -33.28 71.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.856 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -87.62 -60.02 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.86 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 73.1 m -69.37 107.3 3.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.89 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.2 mp -100.88 -31.69 11.02 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.838 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -100.27 -64.18 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.902 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -59.86 162.6 5.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.171 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.098 179.931 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 4.9 p -137.05 -63.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.199 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.9 156.7 48.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.937 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.95 133.51 29.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.031 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.5 m -97.07 177.51 5.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.951 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 39.7 t -66.2 -15.47 63.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.17 -29.35 21.88 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.082 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . 0.416 ' HA ' ' CE3' ' A' ' 378' ' ' TRP . 1.5 tp -59.87 -40.18 82.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . 0.409 ' CD1' HG22 ' A' ' 375' ' ' ILE . 86.5 m-85 -70.97 -38.3 72.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -71.49 -31.35 67.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.416 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 44.2 m0 -65.48 -44.44 87.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . 0.41 HG13 ' CE1' ' A' ' 393' ' ' PHE . 22.0 t -68.64 -43.11 83.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.074 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 34.5 mtt180 -60.38 -44.62 95.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.87 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -69.46 -37.23 77.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -43.68 94.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 59.4 mt -60.41 -38.2 83.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.833 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -78.36 -31.82 48.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 11.5 mtt-85 -64.87 -65.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -74.12 -30.87 62.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.181 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 76.52 45.82 13.13 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.522 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.415 HD12 ' CE1' ' A' ' 444' ' ' TYR . 27.7 pt -108.11 165.07 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.82 0.343 . . . . 0.0 111.179 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 43.8 m -81.67 154.03 26.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -60.39 -29.2 68.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.995 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.97 -45.09 87.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.2 t -70.66 -49.9 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.04 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . 0.41 ' CE1' HG13 ' A' ' 379' ' ' VAL . 37.5 t80 -61.87 -41.02 97.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.9 70.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.161 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -48.18 16.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.924 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 16.7 m -73.79 -29.1 25.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.225 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.78 -60.96 2.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.131 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -146.89 105.88 3.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -74.29 100.67 3.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.35 -69.38 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.2 p -153.03 134.04 14.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.156 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.47 139.75 45.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 99.35 -24.59 31.6 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.581 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.6 tp -62.75 -36.16 82.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 9.1 tt -58.56 -46.85 86.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.028 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -28.85 66.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.965 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -78.71 -41.68 30.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 19.3 mt -65.7 -38.9 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 13.5 mt -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -69.45 -31.42 69.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 20.3 mttp -85.2 -45.84 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 61.28 31.95 19.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.814 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.24 169.96 9.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.08 130.37 26.31 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.832 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 -25.92 27.9 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.465 2.11 . . . . 0.0 112.364 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -58.13 -33.75 69.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.999 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 8.9 t -111.32 -19.82 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.353 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -53.78 173.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.9 0.381 . . . . 0.0 111.311 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 53.0 m -81.25 -179.78 7.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.93 67.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.846 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -46.23 88.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.879 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.2 tp -61.83 -39.9 93.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.2 mt -59.07 -32.88 70.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.738 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 22.2 t -77.67 -34.91 20.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.04 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -72.37 -47.32 50.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.57 -34.89 76.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.785 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.3 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.79 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.49 87.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.989 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.1 mtp -64.79 -35.67 81.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.808 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -62.86 -45.9 90.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.763 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -61.95 -42.96 99.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.812 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.03 -44.05 97.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.77 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 22.6 mt -71.58 -25.82 62.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.041 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -69.88 -29.38 66.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.95 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 60.3 mt -58.94 154.81 36.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.968 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.27 162.87 38.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.624 2.216 . . . . 0.0 112.275 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -59.63 -37.21 78.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.74 -38.93 92.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.08 -41.77 58.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -59.81 -45.82 91.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -62.44 -39.06 92.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -62.81 -35.55 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 8.7 mt -76.48 -34.12 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.06 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.415 ' CE1' HD12 ' A' ' 388' ' ' ILE . 12.2 m-85 -66.16 -54.07 29.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -60.7 -37.8 82.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.955 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -72.92 97.94 2.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -127.71 143.85 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.947 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.84 30.84 3.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -95.46 -62.49 1.29 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.961 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.88 31.84 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.929 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.3 m -74.34 109.6 7.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.812 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 10.9 mp -122.39 49.04 1.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -59.59 116.88 4.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.899 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -74.64 -62.54 1.5 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.149 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.909 . . . . 0.0 111.132 179.961 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.732 0.301 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.39 30.98 8.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.079 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -162.03 121.54 2.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t -114.52 113.63 44.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.191 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.04 -175.22 2.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -23.95 63.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.119 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.02 -28.55 62.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 6.0 tp -58.01 -35.73 53.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.146 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -76.65 -40.36 49.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.864 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -69.46 -30.97 68.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.9 m0 -67.79 -43.07 80.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.952 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.4 t -58.82 -44.55 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.129 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -72.18 -49.11 38.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.975 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.9 -30.53 69.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.992 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -80.91 -38.49 27.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.995 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.95 -40.41 94.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.969 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 -32.14 65.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.995 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.51 -31.35 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.06 -52.82 6.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 88.15 72.09 1.28 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.502 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.404 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 21.4 pt -148.77 173.59 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 111.158 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 3.2 m -90.41 152.6 20.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -30.82 70.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.862 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.64 98.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.127 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.8 t -70.61 -48.21 59.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.161 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -58.28 -48.65 79.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.53 -30.71 69.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -76.0 -55.28 5.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.867 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 23.9 m -67.04 -27.91 41.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.211 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -77.4 -73.85 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -128.92 113.08 14.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -78.8 90.54 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -132.77 -66.19 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -163.84 155.67 16.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 8.3 tm0? -85.19 137.69 32.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.7 -27.57 17.2 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.78 -31.49 69.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 110.932 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.44 -48.46 81.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 9.5 m -61.54 -38.66 88.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -40.68 90.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.002 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 7.4 mt -67.7 -37.28 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.118 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 91.9 mt -79.22 -27.69 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.998 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.68 -31.01 64.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -69.05 -42.81 75.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 61.25 27.59 17.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.979 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.0 161.6 13.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.864 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.0 142.78 25.26 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.979 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -54.85 -19.86 20.6 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.38 2.053 . . . . 0.0 112.584 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -49.17 -27.98 4.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.327 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 p -125.02 20.95 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.453 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.19 -173.02 2.32 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.05 178.66 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.752 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.03 -31.03 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 22.6 t -58.94 -49.94 75.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 18.2 tp -62.08 -38.32 88.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.63 -30.81 68.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.815 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.98 -50.12 39.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.204 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -60.55 -44.04 96.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 7.9 mp -65.68 -31.54 72.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.22 -51.37 69.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.16 70.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -44.29 78.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -64.08 -44.96 90.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -60.36 -40.83 92.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.09 -33.6 76.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.785 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 13.4 mt -83.74 -27.74 28.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.998 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -74.9 -28.18 60.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.984 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 161.89 4.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.33 148.39 79.74 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.513 2.142 . . . . 0.0 112.32 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.46 -31.29 69.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.963 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -46.07 90.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -45.16 68.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.961 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -58.19 -36.86 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.29 -37.58 87.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.811 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -75.0 -34.59 61.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.823 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 9.8 mt -75.75 -10.88 13.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.459 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.404 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 4.8 m-85 -95.76 -29.63 14.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.2 -16.35 21.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.436 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 52.7 p-10 -68.64 71.05 0.2 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.928 0.394 . . . . 0.0 111.041 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.14 134.59 55.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.93 120.95 24.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.881 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -77.38 -8.46 57.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.343 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.01 -30.31 59.22 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.804 0.335 . . . . 0.0 111.003 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.3 t -65.56 -169.71 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.12 146.64 47.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.814 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -60.49 159.87 9.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -97.69 37.89 1.34 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.121 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.08 -179.973 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 10.6 m120 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.762 0.315 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.8 p -135.73 131.77 36.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.04 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -95.54 122.47 38.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.833 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.7 t -110.35 133.15 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.0 m -99.8 163.1 12.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.2 t -66.31 -20.88 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.6 -27.53 11.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 111.199 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 8.9 tp -58.02 -44.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.109 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -66.85 -40.83 88.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -66.91 -32.35 73.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 54.6 m0 -69.07 -46.75 67.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.933 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 21.5 t -60.53 -33.3 53.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . 0.4 ' HB3' ' NH1' ' A' ' 380' ' ' ARG . 2.1 mmm180 -74.13 -43.55 57.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.813 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.21 -35.55 71.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.833 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.77 -36.49 78.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.891 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -35.83 79.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.851 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -72.46 -38.85 68.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -43.95 57.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.828 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.73 -32.02 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 64.54 30.81 78.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.41 HD13 ' CE1' ' A' ' 444' ' ' TYR . 42.6 pt -102.45 162.19 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.745 0.307 . . . . 0.0 111.154 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.42 151.78 42.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -62.76 -31.67 72.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.09 96.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.02 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -70.9 -43.12 77.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -61.99 -44.78 96.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.56 71.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.138 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -72.86 -35.33 67.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -87.99 -31.48 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -78.53 -63.03 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.086 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -140.12 98.42 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 97.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.919 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -136.37 -67.0 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 66.8 p -156.37 147.38 22.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.092 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.9 136.85 38.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 98.26 -27.42 19.43 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 9.8 tp -59.4 -36.03 75.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.88 -31.07 69.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.959 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 54.3 m -74.99 -44.92 45.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.98 -41.04 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 13.6 mt -69.38 -32.27 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -81.55 -30.67 33.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -44.1 61.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -45.52 91.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.952 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.99 31.3 19.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.34 151.72 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.05 146.57 63.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.94 -27.31 14.41 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.524 2.15 . . . . 0.0 112.405 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -58.39 -33.06 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.975 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 24.9 p -114.88 27.24 9.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.207 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.06 -169.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 18.5 m -99.59 173.13 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -62.79 -47.58 82.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 6.3 p -59.31 -39.82 84.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.82 -34.58 75.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.66 -35.43 67.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 24.1 t -65.69 -47.41 86.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.028 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -65.54 -37.65 87.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.93 -35.28 78.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.37 -44.9 95.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.12 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.043 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.6 mtm -64.78 -36.37 84.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -67.95 -42.87 80.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.28 -40.95 97.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -62.97 -35.7 81.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 11.3 mt -79.49 -26.63 41.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.934 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -70.0 -28.28 65.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.928 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.98 155.3 24.67 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.97 163.5 35.46 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.559 2.173 . . . . 0.0 112.286 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -59.58 -31.47 69.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.52 75.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.192 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -75.35 -51.61 12.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.406 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 6.2 mtp180 -58.76 -38.64 78.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.905 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.1 -47.99 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.951 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -39.8 77.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.033 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 18.0 mt -73.07 -45.36 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.14 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.41 ' CE1' HD13 ' A' ' 388' ' ' ILE . 16.2 m-85 -62.96 -49.95 72.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -28.41 67.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.28 77.01 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.939 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -177.89 148.05 0.5 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 40.4 mtt-85 -61.59 -76.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -99.96 172.72 7.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.894 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.98 -64.74 1.01 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 2.3 t -99.97 -66.53 0.9 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.995 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 1.3 mp -65.37 154.24 38.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.968 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -140.05 117.67 11.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -71.74 157.88 37.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.177 -0.916 . . . . 0.0 111.128 179.997 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.847 0.356 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 6.6 t -173.04 142.49 1.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.15 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -91.13 151.19 21.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 7.9 t -70.04 94.74 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.5 m -62.78 -177.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.003 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.4 m -66.93 -22.35 65.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.054 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . 0.417 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 36.5 mt-10 -51.02 -27.39 7.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.175 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . 0.414 ' HA ' ' CE3' ' A' ' 378' ' ' TRP . 7.4 tp -59.58 -44.89 94.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -65.74 -36.87 84.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.798 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.04 -31.01 68.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.417 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.1 m0 -72.05 -45.91 58.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 30.4 t -60.47 -33.57 54.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.033 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -69.3 -41.25 77.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -37.0 50.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.951 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -61.21 -39.14 89.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.963 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 26.8 mt -74.14 -32.2 63.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.21 -31.56 62.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.967 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 16.0 mmt85 -77.96 -62.2 1.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.35 84.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.111 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 69.82 64.39 2.94 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.448 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.452 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 25.2 pt -131.56 157.28 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.759 0.314 . . . . 0.0 111.181 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 4.9 p -65.0 157.07 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -34.55 76.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.71 -30.88 69.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.108 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -77.1 -50.66 20.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -64.68 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.65 -41.79 87.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.167 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -47.65 70.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.847 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 35.7 m -69.43 -37.89 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.186 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -72.27 -70.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -134.49 113.28 11.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.857 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -60.34 96.54 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.86 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -147.79 178.82 8.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.759 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.01 151.0 46.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -67.95 149.24 50.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.946 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.29 -27.72 15.92 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.542 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.87 -34.09 74.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.834 0.35 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.76 -50.44 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.8 p -60.27 -30.64 69.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -71.49 -33.22 69.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.957 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.2 -36.25 24.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.09 -35.18 64.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -55.66 5.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -60.07 -48.41 81.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.878 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 60.13 30.96 20.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.989 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.8 115.68 6.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.49 149.17 84.64 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.49 47.36 2.33 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.844 2.363 . . . . 0.0 112.823 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -100.15 -50.87 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 0.0 110.91 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.11 30.7 6.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -90.84 -177.48 4.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.087 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.5 178.58 6.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -75.14 -30.22 60.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.964 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -50.5 73.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.089 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 56.0 tp -64.72 -41.43 95.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.65 -38.87 79.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 32.2 t -67.52 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -42.33 54.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.786 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.18 -42.3 99.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.795 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -60.53 -40.92 93.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.29 99.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.063 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.9 mtm -70.14 -34.93 73.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.822 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -69.02 -47.09 66.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.715 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -59.64 -37.59 79.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -67.88 -44.55 76.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 18.2 mt -72.49 -33.22 66.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.811 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -69.89 -31.61 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.786 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.15 159.86 13.6 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.49 148.29 87.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.464 2.109 . . . . 0.0 112.32 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.7 -30.03 67.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.994 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -57.82 -40.48 80.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.119 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -51.81 23.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 86.7 mtm-85 -59.72 -30.79 69.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -55.54 31.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.932 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.76 -43.99 97.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.976 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 24.4 mt -58.93 -30.68 43.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.048 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.452 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 15.0 m-85 -87.47 -38.25 16.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.832 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -100.12 27.7 5.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -77.42 -175.4 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.76 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -108.07 114.51 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -65.53 78.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.791 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -94.23 -176.03 3.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.1 57.32 4.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.846 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 2.9 p -95.52 43.71 1.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -147.96 117.46 7.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.903 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -117.48 42.03 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.81 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -77.28 138.14 39.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.995 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.863 0.363 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 3.8 t -98.07 -32.54 11.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.1 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -90.42 166.59 13.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 30.8 t -103.58 109.7 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 1.6 m -95.1 -176.69 3.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.951 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 66.4 m -66.61 -20.92 66.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.222 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -51.74 -29.62 19.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.877 0.37 . . . . 0.0 111.167 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . 0.424 ' HA ' ' CE3' ' A' ' 378' ' ' TRP . 1.0 OUTLIER -59.43 -44.23 92.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.11 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -62.93 -48.77 77.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -32.25 68.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.754 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 378' ' ' TRP . . . . . 0.424 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 54.4 m0 -64.1 -48.62 75.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.086 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 23.2 t -57.27 -42.12 79.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.353 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -60.58 -44.19 96.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -73.4 -41.84 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -42.37 95.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.048 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 15.0 mt -60.32 -49.47 77.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.861 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -70.03 -37.89 75.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -67.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.04 -45.34 93.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.191 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 84.92 72.88 1.28 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.429 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 388' ' ' ILE . . . . . 0.421 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 19.5 pt -148.41 156.17 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.833 0.349 . . . . 0.0 111.127 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.01 152.96 42.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.895 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.34 -30.07 69.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.868 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -58.52 -38.19 77.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.144 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.2 t -77.9 -50.51 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.006 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -58.2 -35.02 71.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.014 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.76 61.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.087 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -31.26 41.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -89.0 -27.9 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.181 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -76.58 -61.6 1.91 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -146.13 119.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.894 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -76.45 101.4 5.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.29 -65.9 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.65 155.78 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.054 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.09 -32.98 39.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.945 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.29 27.16 18.14 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.56 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 13.6 tp -100.09 -38.17 8.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.47 -33.71 71.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 30.8 t -76.73 -31.58 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.889 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.4 -35.61 75.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 408' ' ' ILE . . . . . . . . . . . . . 9.9 mt -69.85 -40.49 78.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.7 mt -75.98 -31.01 58.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.898 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -71.01 -37.9 72.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.35 -39.48 78.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 61.06 29.73 19.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 136.62 32.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.21 147.23 37.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.86 -23.48 21.05 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.415 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -54.64 -29.78 53.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.065 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -130.86 19.75 5.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.297 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.13 163.64 14.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.196 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 3.1 p -80.02 -178.12 6.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.84 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 420' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -69.42 -43.89 72.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.861 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 15.8 m -58.51 -34.15 70.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -71.88 -38.13 70.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 35.8 mt -64.68 -40.4 95.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' VAL . . . . . . . . . . . . . 42.3 t -66.38 -46.12 87.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.05 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -60.52 -41.5 94.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.48 -33.82 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.975 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -60.86 -44.47 96.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.82 76.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.0 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.5 ttm -68.05 -43.09 79.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -60.68 -47.97 83.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -61.43 -41.6 97.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 42.1 mt -73.71 -28.38 61.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.022 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -69.97 -38.85 76.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 5.9 mt -60.7 145.27 88.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.059 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.12 164.72 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.574 2.183 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.72 -33.41 75.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.48 81.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.021 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -50.5 41.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.715 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 88.2 mtm-85 -57.75 -36.02 71.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.784 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -54.16 49.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.09 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 10.0 mtp-105 -58.86 -47.87 83.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 56.0 mt -60.27 -28.74 42.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' TYR . . . . . 0.421 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.9 m-85 -72.91 -44.21 61.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -100.05 21.81 12.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.476 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 48.8 p-10 -78.95 61.3 3.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 110.99 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -127.63 32.28 5.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.47 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -60.31 -39.73 88.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.39 -33.38 15.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 58.7 m -85.83 57.04 4.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -141.93 96.62 3.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -98.86 27.96 4.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.073 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -100.0 -49.87 4.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.07 -179.969 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 371' ' ' VAL . . . . . 0.473 HG12 ' HG2' ' A' ' 415' ' ' PRO . 21.5 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 111.098 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.1 m -100.02 179.39 4.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.9 -19.37 65.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.199 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.0 mt-10 -51.7 -27.13 10.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.202 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.568 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.3 tp -57.7 -43.65 84.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.998 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.469 ' N ' HG23 ' A' ' 375' ' ' ILE . 96.6 m-85 -72.06 -38.16 69.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.785 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -32.95 73.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.427 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.7 m0 -65.07 -43.91 90.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -58.53 -41.11 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.62 -37.21 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.56 -39.44 62.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.72 -36.68 81.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.07 -37.42 72.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -78.12 -31.4 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -53.46 7.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.931 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -67.39 -47.08 71.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 82.55 61.03 2.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.506 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.629 HD13 ' CE1' ' A' ' 444' ' ' TYR . 22.8 pt -134.46 166.2 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.813 0.339 . . . . 0.0 111.153 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.46 157.31 34.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -64.1 -31.45 72.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 391' ' ' ALA . . . . . 0.413 ' HB2' ' OE1' ' A' ' 402' ' ' GLN . . . -60.63 -35.95 77.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.076 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 396' ' ' VAL . 23.3 t -75.33 -56.56 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.068 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.421 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -59.1 -30.53 68.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -76.75 -29.93 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.268 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -81.55 -31.07 32.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.985 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.8 m -88.47 -27.15 5.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.274 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -80.35 -52.43 7.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.072 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.454 ' HE1' HD12 ' A' ' 405' ' ' LEU . 3.0 p90 -154.92 89.26 1.22 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.886 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.55 120.34 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 400' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 401' ' ' THR . 0.3 OUTLIER -161.91 -72.14 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.819 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 401' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.3 OUTLIER -164.29 129.97 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.051 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 402' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 391' ' ' ALA . 0.5 OUTLIER -63.46 151.43 41.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.822 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.46 -28.01 14.98 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.458 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.468 ' HG ' HD11 ' A' ' 408' ' ' ILE . 12.7 tp -66.52 -39.81 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.861 0.362 . . . . 0.0 110.939 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.521 HD21 HD12 ' A' ' 409' ' ' LEU . 7.4 tt -58.74 -29.48 66.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.029 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.9 t -68.93 -43.0 75.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -69.74 -37.46 76.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.654 HG23 HD21 ' A' ' 422' ' ' LEU . 16.4 mt -69.37 -34.08 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.232 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.521 HD12 HD21 ' A' ' 405' ' ' LEU . 3.4 mt -81.59 -31.81 32.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -66.31 -48.65 69.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.835 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -67.87 -47.58 68.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.95 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 61.21 30.0 19.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.6 136.39 55.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -74.22 144.35 81.52 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.473 ' HG2' HG12 ' A' ' 371' ' ' VAL . 52.7 Cg_exo -52.66 -27.35 33.04 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.565 2.177 . . . . 0.0 112.231 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -38.14 77.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.974 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 m -120.73 30.55 6.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 167.41 10.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 37.5 m -85.38 175.02 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.857 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.531 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.9 mt-30 -62.74 -51.28 67.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.86 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 4.0 t -59.3 -30.82 68.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.654 HD21 HG23 ' A' ' 408' ' ' ILE . 2.7 tm? -71.42 -44.18 65.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.17 -36.99 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.945 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -69.5 -33.07 55.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.241 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.54 -48.16 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 422' ' ' LEU . 16.1 mt -68.24 -32.74 73.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -43.64 97.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.956 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -70.85 -40.22 72.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.143 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.4 mtt -63.42 -31.4 72.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.939 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -70.23 -46.66 64.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -60.19 -35.91 76.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.37 -38.13 77.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.93 -31.69 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -72.75 -29.6 63.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.35 159.87 10.78 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.89 151.76 73.79 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.626 2.217 . . . . 0.0 112.311 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.06 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.79 -38.77 79.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.46 -48.13 51.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 42.3 mtm180 -59.48 -34.07 72.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.932 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -64.57 -41.14 96.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.6 -33.6 74.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.87 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 20.4 mt -77.51 -40.63 28.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.068 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.629 ' CE1' HD13 ' A' ' 388' ' ' ILE . 9.5 m-85 -66.19 -35.34 80.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.962 0.41 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.878 -179.969 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.856 0.36 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.697 ' O ' HG22 ' A' ' 375' ' ' ILE . 64.3 m -86.29 173.01 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.935 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 55.0 m -62.18 -24.11 67.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.123 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -53.28 -27.65 23.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.781 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.9 tp -57.99 -37.49 61.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.051 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.443 ' OH ' HD21 ' A' ' 426' ' ' LEU . 88.8 m-85 -75.69 -42.69 50.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.887 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.85 -31.15 72.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.927 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.403 ' HB3' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -71.01 -44.28 66.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 375' ' ' ILE . 29.5 t -59.48 -33.87 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -76.46 -45.52 30.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -67.4 -40.24 85.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.004 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -31.69 70.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.982 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.4 mt -71.11 -32.03 68.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.979 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.36 -31.18 17.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.919 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -80.13 -32.9 38.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -80.32 -53.29 6.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.102 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 93.64 59.32 1.21 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.511 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.447 HD13 ' CE1' ' A' ' 444' ' ' TYR . 16.7 pt -140.34 179.23 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.918 0.389 . . . . 0.0 111.067 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.09 149.76 21.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.99 -29.6 65.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.051 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.4 -49.0 79.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.873 ' O ' HG22 ' A' ' 396' ' ' VAL . 25.3 t -66.28 -50.53 67.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.127 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.526 ' CE1' HG13 ' A' ' 379' ' ' VAL . 14.0 t80 -57.78 -30.98 66.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.019 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.47 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -82.77 -30.28 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.72 -31.24 36.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.91 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.873 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.6 m -86.05 -30.03 6.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.198 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.25 -43.14 24.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.086 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.443 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 14.3 p90 -166.98 111.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.74 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.53 124.82 20.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 400' ' ' ARG . . . . . 0.409 ' N ' ' HD3' ' A' ' 400' ' ' ARG . 0.0 OUTLIER -160.74 -177.42 6.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.954 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -84.2 144.38 29.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.029 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.5 139.27 55.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 105.11 -27.61 17.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.502 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.422 ' HG ' HD11 ' A' ' 408' ' ' ILE . 4.8 tp -64.08 -55.88 18.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 408' ' ' ILE . 0.5 OUTLIER -59.02 -32.81 70.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.966 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.18 -30.49 68.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.851 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -39.22 21.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 405' ' ' LEU . 10.1 mt -65.61 -34.58 71.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 8.4 mt -78.74 -31.47 46.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.786 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -72.5 -44.29 62.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -60.23 -49.39 77.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.856 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.44 31.23 20.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.906 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -85.12 151.12 24.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.91 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.52 144.14 80.31 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.13 -4.32 15.21 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.529 2.153 . . . . 0.0 112.673 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -56.86 -46.39 81.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.747 0.308 . . . . 0.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 p -109.29 31.67 5.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.167 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.79 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -99.99 164.55 11.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.18 174.19 11.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.834 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.664 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -64.8 -39.35 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.2 p -58.73 -41.02 85.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.79 HD23 ' CB ' ' A' ' 418' ' ' ALA . 19.8 tp -69.04 -31.24 69.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.879 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.21 -44.51 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.8 t -59.7 -43.73 92.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -67.98 -44.72 76.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.443 HD21 ' OH ' ' A' ' 376' ' ' TYR . 6.8 mp -67.1 -39.84 86.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.946 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -60.44 -41.1 93.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.867 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.102 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.36 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.43 -38.04 71.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.809 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.53 -42.91 95.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.563 ' HA ' HD12 ' A' ' 435' ' ' LEU . 24.3 t80 -62.37 -46.42 88.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 378' ' ' TRP . 34.0 mt -65.53 -29.74 70.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.01 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -70.06 -29.62 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.936 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 432' ' ' PHE . 35.9 mt -58.49 147.9 67.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.86 158.76 5.91 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.576 2.184 . . . . 0.0 112.224 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.53 -31.46 72.68 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.894 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -68.28 -35.1 77.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -75.44 -39.57 58.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.906 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -59.75 -42.17 92.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.53 81.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -42.04 90.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.87 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 29.6 mt -74.76 -29.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.203 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.447 ' CE1' HD13 ' A' ' 388' ' ' ILE . 5.9 m-85 -69.51 -46.59 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.887 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.959 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 371' ' ' VAL . . . . . 0.614 HG11 HD23 ' A' ' 426' ' ' LEU . 21.3 t . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.841 0.353 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.566 ' O ' HG22 ' A' ' 375' ' ' ILE . 18.1 m -94.95 -178.44 4.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.014 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -19.72 64.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.093 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -54.0 -27.9 34.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.214 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.662 ' O ' HG23 ' A' ' 379' ' ' VAL . 0.9 OUTLIER -58.57 -39.32 75.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.123 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.497 ' CD1' HG23 ' A' ' 375' ' ' ILE . 34.3 m-85 -76.63 -34.36 58.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.995 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -30.82 63.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.0 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -68.34 -46.61 69.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.28 -39.66 79.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.172 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -68.97 -39.02 79.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -74.46 -32.48 62.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.907 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -71.03 -47.85 56.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.59 -34.28 73.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -69.87 -31.71 69.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -44.05 17.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.95 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -68.79 -55.01 12.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.085 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.9 31.61 9.13 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 17.2 pt -109.86 164.02 6.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.81 0.338 . . . . 0.0 111.09 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 152.4 41.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -31.11 69.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.91 96.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.134 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.5 t -63.41 -51.9 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -61.68 -31.15 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -74.63 -32.19 62.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.9 ttt85 -72.26 -42.44 65.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.942 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.4 m -78.03 -33.7 18.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.19 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.86 -72.24 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.11 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.491 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 3.3 p90 -131.79 114.57 14.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.32 88.8 3.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.923 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -143.92 -74.62 0.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 36.9 p -148.7 171.02 16.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.0 -33.36 10.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.991 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.89 -27.47 72.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.623 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' ' 408' ' ' ILE . 33.3 tp -60.84 -46.02 92.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 394' ' ' ALA . 5.7 tt -56.95 -32.09 65.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.062 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -29.69 40.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.86 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -31.87 59.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.031 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.699 HD11 ' HG ' ' A' ' 404' ' ' LEU . 8.0 mt -73.56 -45.08 52.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.091 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.16 -44.62 62.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.045 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -62.4 -30.72 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.983 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -82.5 -44.51 15.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 61.55 30.51 18.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -86.97 164.86 16.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.786 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -93.18 151.97 40.87 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.39 -22.2 29.53 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.598 2.199 . . . . 0.0 112.457 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -29.95 60.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.155 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 67.9 p -100.91 -31.0 11.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.756 ' CB ' HD13 ' A' ' 422' ' ' LEU . . . -60.37 171.15 1.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.05 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.18 171.76 13.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.91 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.489 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.4 tt0 -59.77 -31.74 69.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 p -58.75 -45.88 88.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.756 HD13 ' CB ' ' A' ' 418' ' ' ALA . 4.8 tt -62.55 -37.53 86.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.98 -31.81 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.782 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -71.25 -44.08 73.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.199 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -73.8 -43.6 58.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.703 HD13 HD21 ' A' ' 422' ' ' LEU . 3.8 tp -60.65 -49.2 78.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.911 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -32.18 70.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.724 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.96 92.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.972 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 429' ' ' MET . . . . . 0.451 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 41.1 mtt -62.5 -42.11 99.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -64.54 -41.3 96.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.836 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -60.31 -52.61 64.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.938 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 443' ' ' ILE . 19.9 t80 -59.23 -46.27 88.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.74 -31.54 72.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.891 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -71.16 -28.37 64.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.018 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 82.9 mt -57.1 153.06 26.33 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.971 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.87 146.87 27.11 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.606 2.204 . . . . 0.0 112.386 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -64.76 -34.01 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.886 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.66 75.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.108 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -51.1 17.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.871 ' HA ' HD12 ' A' ' 443' ' ' ILE . 78.7 mtm180 -58.92 -29.48 67.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -46.92 69.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.171 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -65.75 -29.34 69.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.067 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 440' ' ' ARG . 11.2 mt -73.03 -36.78 51.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.87 0.367 . . . . 0.0 111.026 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -71.38 -31.67 67.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.917 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 27.7 t . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.735 0.302 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.685 ' O ' HG22 ' A' ' 375' ' ' ILE . 14.4 m -86.55 -174.96 5.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 63.4 p -71.88 -23.96 61.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.037 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.6 mt-10 -54.18 -27.2 32.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.139 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.685 HG22 ' O ' ' A' ' 372' ' ' SER . 8.3 tp -57.9 -40.95 78.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.138 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.418 ' N ' HG23 ' A' ' 375' ' ' ILE . 93.7 m-85 -73.93 -34.13 64.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -71.65 -33.07 68.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.421 ' HB3' HD22 ' A' ' 433' ' ' LEU . 53.9 m0 -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 375' ' ' ILE . 31.8 t -60.26 -47.6 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.066 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -40.85 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.803 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.25 -34.7 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.925 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.94 -41.92 73.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 383' ' ' LEU . 12.3 mt -65.91 -44.41 85.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -39.5 89.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -67.17 -51.8 49.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.909 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -66.46 -62.17 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.078 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.52 28.42 7.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.502 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 10.4 pt -100.8 166.71 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 75.1 m -79.39 159.35 27.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.477 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.09 -31.49 70.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -63.26 -38.93 93.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.148 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.506 ' O ' HG22 ' A' ' 396' ' ' VAL . 27.5 t -75.7 -34.51 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 33.1 t80 -73.67 -43.17 60.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.946 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.85 -32.32 72.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -68.56 -55.4 11.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.0 m -64.42 -35.87 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.117 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -71.98 -69.15 0.41 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.205 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.415 ' N ' ' CD1' ' A' ' 398' ' ' PHE . 4.7 p90 -139.68 110.68 6.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.969 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.6 93.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.66 -165.47 2.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.801 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.86 131.09 43.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -59.01 -32.23 69.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.082 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.65 -20.6 77.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.703 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.512 ' HG ' HD11 ' A' ' 408' ' ' ILE . 24.0 tp -64.77 -48.02 76.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.915 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.8 tt -57.88 -36.65 72.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.065 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.8 p -67.15 -29.89 69.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -80.1 -35.83 36.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.956 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.915 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -66.29 -37.1 78.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.058 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.13 -32.52 33.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -71.07 -49.58 43.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -73.57 -33.7 64.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.93 31.09 20.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 413' ' ' GLU . . . . . 0.417 ' OE2' HG23 ' A' ' 417' ' ' THR . 9.1 tp10 -64.19 98.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.02 155.45 54.58 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.869 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.567 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 34.3 Cg_endo -64.31 -19.25 65.46 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.656 2.237 . . . . 0.0 112.464 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -58.26 -29.53 65.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.02 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 417' ' ' THR . . . . . 0.417 HG23 ' OE2' ' A' ' 413' ' ' GLU . 9.0 t -133.91 19.15 3.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.489 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.567 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -93.68 146.43 23.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.48 179.04 0.65 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.907 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.569 ' O ' HG23 ' A' ' 424' ' ' VAL . 7.4 mm-40 -66.7 -39.32 88.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.051 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -45.14 93.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.746 ' O ' HD13 ' A' ' 422' ' ' LEU . 3.3 tm? -62.13 -33.02 73.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.802 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.53 -32.55 72.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -67.43 -51.1 55.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.142 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -63.44 -36.49 83.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.004 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.12 -38.81 79.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -63.32 -39.86 95.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.3 -38.72 92.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.112 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 3.1 ttm -67.97 -33.66 75.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.855 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -70.25 -39.92 74.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.81 -50.38 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.945 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.65 ' HE1' HD13 ' A' ' 443' ' ' ILE . 68.9 t80 -55.53 -41.39 73.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 378' ' ' TRP . 2.2 mt -68.66 -28.78 67.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -82.48 -22.24 35.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.16 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 34.3 mt -53.93 148.79 19.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.096 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 152.13 16.2 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.578 2.185 . . . . 0.0 112.38 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.53 -36.21 81.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.856 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.06 85.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 439' ' ' GLU . . . . . 0.447 ' O ' HD12 ' A' ' 443' ' ' ILE . 0.5 OUTLIER -73.34 -40.08 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.928 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.407 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 50.6 mtm-85 -59.45 -46.56 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -43.47 96.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.908 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -50.56 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.978 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.65 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.1 mt -60.62 -30.65 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 16.4 m-85 -75.79 -40.79 54.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.893 -179.933 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.233 0.184 0 CA-C-O 120.801 0.334 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.557 ' O ' HG22 ' A' ' 375' ' ' ILE . 69.3 m -90.57 166.38 13.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.912 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 6.2 m -59.38 -21.74 60.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.414 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.2 mt-10 -53.4 -27.78 26.01 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.189 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.8 tp -58.72 -45.02 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.105 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.484 ' N ' HG23 ' A' ' 375' ' ' ILE . 69.9 m-85 -66.23 -38.95 89.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.799 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -31.03 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.817 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.678 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.0 m0 -68.44 -42.14 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.04 -51.05 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.19 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -60.53 -48.94 79.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.57 -35.88 82.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -64.86 -47.03 79.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 69.5 mt -60.91 -44.55 96.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -60.22 -31.58 70.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.003 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -85.41 -38.49 18.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.8 -55.62 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.056 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.09 52.16 3.53 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 22.7 pt -131.24 179.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.824 0.345 . . . . 0.0 111.153 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -89.88 154.49 19.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -31.09 69.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.23 94.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.158 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.659 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.1 t -71.89 -31.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.185 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -75.28 -43.96 48.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.003 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.98 78.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.112 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.91 -59.5 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.874 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.6 m -59.87 -39.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.013 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 397' ' ' ALA . . . . . 0.438 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -66.13 -72.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.075 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.8 p90 -130.4 97.31 4.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.834 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -60.14 109.73 1.04 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.971 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 400' ' ' ARG . . . . . 0.716 ' O ' HG23 ' A' ' 401' ' ' THR . 0.6 OUTLIER -154.24 -70.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 401' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.8 OUTLIER -169.4 170.65 8.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -97.12 131.56 43.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.8 -27.95 6.62 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.545 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.55 -45.8 85.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.797 ' CD2' HD12 ' A' ' 409' ' ' LEU . 7.2 tt -58.54 -41.74 86.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.014 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.5 m -64.41 -30.06 71.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -29.22 42.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.02 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.741 HG23 HD21 ' A' ' 422' ' ' LEU . 7.3 mt -80.37 -39.7 19.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.797 HD12 ' CD2' ' A' ' 405' ' ' LEU . 11.7 mt -76.99 -50.67 12.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.139 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -33.36 71.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.026 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -36.66 81.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 60.64 34.75 20.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -91.29 126.14 36.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -71.42 148.99 93.68 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.954 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.78 -8.39 22.99 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.579 2.186 . . . . 0.0 112.642 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -56.94 -39.42 74.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.793 0.33 . . . . 0.0 111.019 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 80.8 p -125.56 32.49 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.139 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.84 147.77 24.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.106 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 83.1 p -65.66 -178.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 424' ' ' VAL . 3.1 tt0 -72.74 -40.69 65.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 14.4 t -60.37 -43.02 96.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.741 HD21 HG23 ' A' ' 408' ' ' ILE . 3.3 tm? -63.86 -40.98 97.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.18 -30.76 68.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -70.01 -40.2 78.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.037 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -63.25 -37.11 85.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.854 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.726 HD11 ' CD1' ' A' ' 422' ' ' LEU . 13.9 mt -75.57 -32.04 60.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -54.1 43.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.896 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.5 86.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 429' ' ' MET . . . . . 0.438 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 7.5 mtm -68.17 -35.5 78.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.851 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -65.75 -41.14 92.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.874 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -60.6 -40.3 91.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.598 ' HA ' HD12 ' A' ' 435' ' ' LEU . 34.8 t80 -64.18 -32.71 74.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.945 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 378' ' ' TRP . 37.4 mt -80.76 -28.75 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -70.0 -29.53 66.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.982 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.598 HD12 ' HA ' ' A' ' 432' ' ' PHE . 3.7 mt -58.75 151.54 52.68 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 156.76 6.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.546 2.164 . . . . 0.0 112.317 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -66.05 -37.75 86.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.943 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.89 71.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.077 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.92 -38.25 64.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.925 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 36.9 mtm-85 -59.59 -47.23 86.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.816 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.41 -37.46 85.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.84 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -37.14 86.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.428 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.5 mt -79.16 -40.83 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.014 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.405 ' HH ' ' HE2' ' A' ' 432' ' ' PHE . 15.8 m-85 -60.84 -43.17 98.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.841 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.913 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.78 0.324 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.598 ' O ' HG22 ' A' ' 375' ' ' ILE . 3.1 m -97.98 178.77 5.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.98 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.7 t -69.01 -21.14 64.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.118 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.74 -27.95 20.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.089 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.747 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.2 tp -58.38 -40.28 77.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.595 ' OH ' HD21 ' A' ' 426' ' ' LEU . 97.2 m-85 -74.79 -37.26 62.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.83 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -31.37 70.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.704 ' CB ' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -70.7 -42.05 71.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 375' ' ' ILE . 28.0 t -61.8 -48.29 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -49.6 65.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.901 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.75 -45.4 92.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.09 -41.12 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.51 HD23 HG13 ' A' ' 388' ' ' ILE . 5.8 mt -60.21 -31.51 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.962 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.37 -49.75 12.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 3.1 mtt-85 -62.66 -36.78 83.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -79.49 -30.53 42.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 65.5 66.96 2.2 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.482 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.51 HG13 HD23 ' A' ' 383' ' ' LEU . 16.4 pt -143.78 173.43 5.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.809 0.337 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.3 m -91.75 154.04 19.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.945 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.444 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.3 mt-30 -60.12 -30.24 69.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.896 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.31 -41.43 89.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.156 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.6 t -75.57 -51.95 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.38 -29.28 63.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -71.02 -46.36 62.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.2 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.04 -48.69 80.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.9 m -67.42 -27.99 40.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.208 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -85.06 -76.11 0.33 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.21 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.437 ' CE1' HD12 ' A' ' 405' ' ' LEU . 16.3 p90 -125.53 118.48 25.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -74.29 107.71 6.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.841 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 400' ' ' ARG . . . . . 0.645 ' HG3' HG22 ' A' ' 401' ' ' THR . 22.6 tpp180 -154.17 -70.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 401' ' ' THR . . . . . 0.645 HG22 ' HG3' ' A' ' 400' ' ' ARG . 1.8 t -169.99 139.18 1.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -72.73 73.4 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.926 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -179.31 -37.51 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.9 tp -61.55 -29.07 69.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.444 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.8 tt -57.49 -37.1 72.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.968 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 89.1 p -72.71 -40.33 66.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.866 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.23 -42.13 99.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.821 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 422' ' ' LEU . 10.6 mt -67.88 -35.09 70.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 28.6 mt -76.21 -34.36 59.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -68.86 -41.7 78.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -60.44 -33.46 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 44.01 31.84 0.56 Allowed 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.406 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 135.34 33.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -67.2 144.7 98.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.489 ' HB3' HD22 ' A' ' 426' ' ' LEU . 85.7 Cg_endo -78.57 -0.66 10.92 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.538 2.159 . . . . 0.0 112.704 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -65.56 -37.02 85.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.987 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.1 p -123.56 25.93 8.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.269 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.506 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.03 174.9 5.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.119 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 70.2 m -69.76 171.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.819 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.797 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.1 pt20 -74.42 -32.01 62.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 16.7 m -61.17 -41.14 96.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.64 HD11 HG23 ' A' ' 408' ' ' ILE . 52.3 tp -69.11 -41.26 77.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.94 -31.68 70.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 420' ' ' GLN . 25.7 t -71.35 -47.63 58.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -64.56 -35.59 81.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.864 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.595 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.5 mp -67.1 -41.36 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.894 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -39.32 86.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.02 -44.12 97.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.9 mtt -63.26 -33.26 75.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.944 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -67.48 -42.39 83.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.15 -47.2 86.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.79 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.647 ' HE1' HD13 ' A' ' 443' ' ' ILE . 32.5 t80 -62.25 -31.15 71.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 378' ' ' TRP . 18.0 mt -84.59 -23.19 29.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.116 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -31.22 68.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.925 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.682 HD22 ' OE1' ' A' ' 439' ' ' GLU . 12.0 mt -64.98 154.88 85.46 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.74 156.14 59.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.482 2.121 . . . . 0.0 112.237 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -58.68 -30.96 67.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.942 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.37 94.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 439' ' ' GLU . . . . . 0.682 ' OE1' HD22 ' A' ' 435' ' ' LEU . 16.7 mt-10 -73.72 -37.15 65.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.895 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -59.79 -47.44 85.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.11 -41.35 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.647 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.2 mt -70.53 -32.95 51.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.134 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.427 ' CD1' HD13 ' A' ' 388' ' ' ILE . 14.2 m-85 -68.15 -39.64 82.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.941 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.874 0.369 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.656 ' O ' HG22 ' A' ' 375' ' ' ILE . 10.7 m -85.25 -177.07 6.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.785 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -25.88 61.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.8 mm-40 -54.79 -25.21 26.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.661 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.1 tp -56.99 -42.95 80.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.131 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.607 ' OH ' HD21 ' A' ' 426' ' ' LEU . 84.2 m-85 -72.63 -42.36 64.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.82 -31.31 72.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.826 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.442 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 35.6 m0 -67.46 -40.01 85.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -57.9 -59.44 3.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.11 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 45.1 mtt-85 -54.16 -34.91 61.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.99 -30.31 58.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 382' ' ' GLU . . . . . 0.457 ' OE1' HD21 ' A' ' 433' ' ' LEU . 4.6 tt0 -78.35 -36.17 46.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 393' ' ' PHE . 4.1 mm? -67.54 -44.39 78.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 52.2 tttt -69.76 -45.97 66.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.892 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.61 -54.84 41.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.94 -30.83 69.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.132 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 71.84 40.21 58.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.449 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 29.0 pt -125.37 176.86 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.162 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 95.1 p -91.61 155.42 18.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.989 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -59.19 -27.98 66.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.24 82.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.691 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.6 t -72.53 -31.32 37.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.425 ' CD2' HD21 ' A' ' 383' ' ' LEU . 71.6 t80 -73.39 -48.02 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.43 -36.99 76.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -67.35 -62.4 1.44 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.7 m -59.52 -29.45 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.168 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -75.26 -58.77 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.993 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.498 ' HE2' HD23 ' A' ' 404' ' ' LEU . 2.4 p90 -148.27 119.21 7.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.33 99.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -169.39 -168.07 0.77 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.736 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.47 149.36 33.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.053 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.91 -31.6 71.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -66.92 -25.86 73.19 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.553 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.498 HD23 ' HE2' ' A' ' 398' ' ' PHE . 6.7 tp -62.31 -50.36 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 0.0 111.005 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.433 HD21 HD12 ' A' ' 409' ' ' LEU . 7.1 tt -58.51 -38.35 77.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.052 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.3 p -68.6 -30.82 69.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.74 -31.41 52.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.996 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.72 HG23 HD11 ' A' ' 422' ' ' LEU . 9.9 mt -80.35 -30.81 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.987 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.433 HD12 HD21 ' A' ' 405' ' ' LEU . 5.0 mt -79.01 -34.62 43.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.832 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -67.79 -36.9 81.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 19.3 mmtm -60.12 -53.4 58.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 60.28 30.85 20.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -99.86 146.55 26.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.41 139.8 87.08 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.787 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -83.06 50.52 3.37 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.732 2.288 . . . . 0.0 112.606 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -100.05 -40.71 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.891 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.2 p -124.36 30.68 5.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.043 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.8 -169.62 2.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.116 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 57.8 m -90.17 172.27 8.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.777 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.9 OUTLIER -69.04 -31.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 92.3 p -59.62 -43.58 93.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.848 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.72 HD11 HG23 ' A' ' 408' ' ' ILE . 13.1 tp -68.21 -34.86 77.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.64 -39.56 84.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.777 HG23 ' O ' ' A' ' 420' ' ' GLN . 26.8 t -66.85 -44.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -64.92 -52.63 55.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.607 HD21 ' OH ' ' A' ' 376' ' ' TYR . 8.1 mp -59.93 -31.26 69.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -44.27 70.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.48 -45.8 82.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.1 mtp -59.85 -34.24 72.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -68.77 -32.4 72.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.49 -34.34 75.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.819 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -69.44 -35.58 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.457 HD21 ' OE1' ' A' ' 382' ' ' GLU . 2.5 mt -79.58 -30.77 41.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -72.79 -27.92 62.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.009 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.32 147.49 57.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.014 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.98 155.92 10.49 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.593 2.195 . . . . 0.0 112.249 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -66.23 -31.75 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.18 77.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.074 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -76.1 -40.17 53.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.864 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.494 ' HA ' HD12 ' A' ' 443' ' ' ILE . 62.2 mtm180 -70.86 -25.62 62.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.106 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.01 -49.5 50.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.062 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -41.91 99.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.094 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.494 HD12 ' HA ' ' A' ' 440' ' ' ARG . 15.8 mt -61.68 -50.17 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.994 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.403 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 12.5 m-85 -61.32 -30.97 70.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.938 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.839 179.915 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 29.0 t . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.831 0.348 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -70.12 169.22 13.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -16.71 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.217 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.433 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.1 mp0 -51.36 -28.15 11.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.762 0.315 . . . . 0.0 111.183 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.619 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.0 tp -58.51 -37.78 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.0 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.603 ' HE1' HG22 ' A' ' 408' ' ' ILE . 36.8 m-85 -73.51 -42.95 61.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.78 -32.17 73.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.99 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.433 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.9 m0 -66.28 -41.9 89.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.921 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 375' ' ' ILE . 32.5 t -61.15 -35.35 65.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.007 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.19 -31.39 65.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -73.8 -37.92 64.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 382' ' ' GLU . . . . . 0.563 ' OE2' ' HB2' ' A' ' 386' ' ' ALA . 1.2 tm-20 -76.2 -37.84 57.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.944 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.34 -31.2 71.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.907 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -86.65 -31.26 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.79 -67.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 386' ' ' ALA . . . . . 0.563 ' HB2' ' OE2' ' A' ' 382' ' ' GLU . . . -59.29 -41.94 90.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 74.18 70.88 1.18 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.488 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.409 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 21.1 pt -134.11 158.0 42.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.055 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.17 160.9 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.802 ' HG2' HD23 ' A' ' 405' ' ' LEU . 2.6 mt-30 -66.19 -31.43 72.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.854 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.59 69.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.212 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.826 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.5 t -84.01 -59.54 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.275 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -58.02 -26.84 62.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -81.05 -40.51 24.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.27 -39.64 59.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.169 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.826 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.4 m -71.61 -32.05 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.224 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -81.22 -66.51 0.88 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.456 ' CE1' ' HE2' ' A' ' 429' ' ' MET . 16.5 p90 -128.36 114.85 17.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -59.59 109.08 0.82 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -169.57 -172.38 1.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -69.84 132.13 45.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.139 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -63.93 154.61 33.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 95.01 -24.5 28.33 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -58.97 -41.11 86.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.791 0.329 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.802 HD23 ' HG2' ' A' ' 390' ' ' GLN . 2.2 tp -57.38 -33.77 68.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 8.0 t -65.41 -43.74 89.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.932 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -69.08 -41.92 76.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.008 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.603 HG22 ' HE1' ' A' ' 376' ' ' TYR . 25.7 mt -62.58 -40.49 88.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.013 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.463 HD23 ' HD1' ' A' ' 376' ' ' TYR . 58.7 mt -72.18 -37.01 69.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.021 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -44.02 73.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mmmt -58.82 -39.53 81.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.013 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 59.62 30.73 20.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -93.52 109.13 20.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.29 167.6 6.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.409 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 55.3 Cg_endo -69.8 -9.97 27.38 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.505 2.137 . . . . 0.0 112.657 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -30.04 46.23 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.02 32.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.144 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -92.74 177.0 6.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.043 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 5.3 m -89.3 173.42 8.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.0 OUTLIER -61.32 -41.73 97.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.934 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 57.9 m -60.82 -41.71 96.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.873 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.547 HD13 ' C ' ' A' ' 422' ' ' LEU . 3.5 tm? -60.43 -42.47 96.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.847 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 25.7 mt -59.86 -42.24 93.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 420' ' ' GLN . 28.0 t -62.37 -30.45 49.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.097 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 425' ' ' ASN . . . . . 0.401 ' OD1' ' CE2' ' A' ' 398' ' ' PHE . 1.9 m-80 -70.95 -44.88 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.535 HD11 HD11 ' A' ' 422' ' ' LEU . 28.7 mt -67.39 -44.25 79.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.894 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 11.3 mtt180 -59.88 -40.17 87.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -71.57 -34.62 70.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 429' ' ' MET . . . . . 0.456 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 7.3 mtt -73.35 -33.84 65.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -66.15 -46.71 76.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -64.75 -38.37 90.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.738 ' HA ' HD12 ' A' ' 435' ' ' LEU . 56.8 t80 -71.17 -34.45 70.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.0 mt -75.53 -30.68 59.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -72.65 -27.4 62.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.738 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.8 mt -56.64 157.44 10.1 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.86 147.35 32.74 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.618 2.212 . . . . 0.0 112.331 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -63.98 -42.29 97.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.959 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.08 -31.66 70.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.65 -42.46 58.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -60.12 -45.19 93.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -62.23 -38.63 89.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.804 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -37.99 82.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.483 HD13 ' HE1' ' A' ' 432' ' ' PHE . 19.8 mt -73.65 -35.85 45.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.036 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.452 ' HE1' HG21 ' A' ' 396' ' ' VAL . 22.2 m-85 -67.14 -41.07 86.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.283 -179.983 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 371' ' ' VAL . . . . . 0.43 HG11 HD13 ' A' ' 426' ' ' LEU . 21.5 t . . . . . 0 N--CA 1.457 -0.105 0 CA-C-O 120.902 0.382 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.65 ' O ' HG22 ' A' ' 375' ' ' ILE . 39.7 m -100.02 173.65 6.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 21.5 t -58.63 -25.42 62.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -55.6 -24.74 34.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.138 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -57.46 -42.54 81.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.116 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.448 ' N ' HG23 ' A' ' 375' ' ' ILE . 87.6 m-85 -72.97 -47.48 45.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.905 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.95 -28.57 66.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.042 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 41.5 m0 -68.17 -56.27 9.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.924 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.421 HG22 HD11 ' A' ' 433' ' ' LEU . 22.3 t -58.65 -47.21 89.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -58.37 -38.72 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.66 -41.45 31.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.51 -40.2 95.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.894 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.24 -56.71 17.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.49 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -69.51 -33.01 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -86.51 -30.68 21.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 70.49 28.43 71.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.57 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 36.3 pt -106.87 164.32 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 151.86 36.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.984 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -60.78 -31.04 70.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.01 -40.21 94.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.8 t -73.65 -32.05 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.089 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -75.87 -51.26 12.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -59.62 -31.15 69.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.146 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -70.13 -43.09 71.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.932 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.01 -32.4 12.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.19 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.18 -65.8 0.76 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.193 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -135.78 106.63 6.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -70.28 95.14 0.98 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.87 -71.37 0.46 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.12 131.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.152 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.48 125.95 25.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.93 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.54 -27.69 6.8 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.507 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.506 HD23 HD11 ' A' ' 408' ' ' ILE . 5.3 tp -63.16 -33.17 74.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.861 0.362 . . . . 0.0 111.036 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 394' ' ' ALA . 3.4 tt -58.57 -43.3 89.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 59.8 p -67.3 -29.66 69.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.21 -44.25 38.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.506 HD11 HD23 ' A' ' 404' ' ' LEU . 12.7 mt -67.92 -33.55 61.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.156 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.5 mm? -76.95 -30.51 56.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.944 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 -67.62 -37.15 82.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -68.47 -50.9 48.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.96 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 61.24 31.58 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -95.68 129.92 42.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.834 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.89 165.6 9.62 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.622 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 57.2 Cg_endo -70.65 -8.97 24.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.614 2.209 . . . . 0.0 112.613 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -56.34 -40.66 74.82 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 t -110.74 -21.6 12.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.369 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -58.25 148.06 28.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.912 0.387 . . . . 0.0 111.109 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 33.9 m -76.89 -178.06 4.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.935 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.831 ' O ' HG23 ' A' ' 424' ' ' VAL . 9.2 tm0? -63.72 -30.45 71.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.923 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.9 m -57.4 -50.95 71.36 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.029 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 426' ' ' LEU . 0.7 OUTLIER -64.29 -40.19 95.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.689 ' HA ' HD12 ' A' ' 426' ' ' LEU . 96.3 mt -58.34 -31.99 68.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.0 t -74.07 -32.37 32.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.976 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -74.78 -40.96 60.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 423' ' ' LEU . 2.8 mt -65.68 -40.76 92.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -59.99 -41.17 91.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.814 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.91 94.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -38.83 73.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -60.9 -45.17 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.72 -39.58 80.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.878 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.58 ' HE1' HD13 ' A' ' 443' ' ' ILE . 86.5 t80 -70.41 -35.73 73.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.421 HD11 HG22 ' A' ' 379' ' ' VAL . 6.5 mt -81.3 -30.93 33.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -70.03 -29.13 66.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.903 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 17.7 mt -58.19 152.53 40.99 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.917 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.03 148.47 23.61 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.524 2.149 . . . . 0.0 112.32 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -60.97 -32.85 72.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.03 -38.08 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.047 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 439' ' ' GLU . . . . . 0.522 ' OE1' HD22 ' A' ' 435' ' ' LEU . 15.9 mt-10 -69.95 -40.2 75.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -60.15 -40.45 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -63.73 -37.23 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.01 -41.29 77.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.58 HD13 ' HE1' ' A' ' 432' ' ' PHE . 13.5 mt -69.43 -38.46 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.081 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -67.06 -33.57 75.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.936 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.549 ' O ' HG22 ' A' ' 375' ' ' ILE . 2.9 m -100.16 168.11 10.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -22.86 64.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 84.2 mt-10 -53.74 -26.61 24.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.211 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.695 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.2 tp -57.27 -44.84 84.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.196 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.492 ' N ' HG23 ' A' ' 375' ' ' ILE . 88.4 m-85 -73.22 -34.24 65.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -30.31 65.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.591 ' CB ' HD13 ' A' ' 433' ' ' LEU . 40.7 m0 -71.41 -37.8 71.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.979 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -64.72 -39.78 86.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.198 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 19.5 mtt-85 -67.97 -55.68 11.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -59.45 -30.66 68.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -78.83 -30.77 45.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.013 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 8.7 mt -68.5 -58.36 4.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -41.19 88.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.908 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -64.65 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.95 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.34 -52.32 65.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.067 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.36 69.29 1.36 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.413 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.493 HD13 ' CE1' ' A' ' 444' ' ' TYR . 33.9 pt -138.02 176.14 7.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 111.124 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 m -90.57 153.84 20.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.02 -30.94 69.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.88 90.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.093 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 396' ' ' VAL . 29.8 t -74.66 -35.32 37.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.176 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.629 ' CZ ' HG13 ' A' ' 379' ' ' VAL . 42.9 t80 -72.06 -25.97 61.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.091 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.42 -55.5 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.348 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -58.38 -46.93 85.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.059 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.687 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.3 m -63.22 -33.07 58.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -84.74 -70.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.454 ' CE2' ' HG2' ' A' ' 400' ' ' ARG . 2.0 p90 -143.05 112.85 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.94 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -58.62 124.77 20.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 400' ' ' ARG . . . . . 0.454 ' HG2' ' CE2' ' A' ' 398' ' ' PHE . 0.0 OUTLIER -170.1 -172.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.91 113.94 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.109 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.29 131.4 10.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.374 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.36 -14.36 10.93 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.784 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.0 tp -79.76 -43.03 23.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.746 0.307 . . . . 0.0 111.04 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.703 HD23 ' O ' ' A' ' 405' ' ' LEU . 9.2 tt -55.39 -28.38 53.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.21 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 24.9 p -70.95 -50.3 36.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.066 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.29 -41.38 94.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.592 HG23 HD11 ' A' ' 422' ' ' LEU . 28.4 mt -59.88 -44.62 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.019 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.552 HD12 ' CD2' ' A' ' 405' ' ' LEU . 7.4 mt -75.52 -30.61 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -47.6 65.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.895 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -66.89 -41.63 86.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 61.24 31.61 19.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.2 137.85 53.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -75.44 149.6 84.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.833 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.69 -5.74 17.56 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.552 2.168 . . . . 0.0 112.683 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -66.27 -57.59 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.774 0.321 . . . . 0.0 111.064 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 76.4 p -108.67 34.32 3.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.215 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 -177.26 3.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.3 174.61 8.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.979 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.655 ' O ' HG23 ' A' ' 424' ' ' VAL . 2.1 mt-30 -71.66 -31.73 67.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.592 HD11 HG23 ' A' ' 408' ' ' ILE . 5.0 tp -63.11 -39.23 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 420' ' ' GLN . 87.0 mt -59.94 -33.99 72.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 420' ' ' GLN . 29.1 t -73.91 -38.14 49.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.071 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -69.28 -50.14 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.938 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.553 HD22 HG21 ' A' ' 375' ' ' ILE . 75.0 mt -57.63 -32.01 66.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.981 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -63.8 -45.56 89.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.25 -43.28 74.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.137 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -35.33 75.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -69.74 -44.27 70.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -64.4 -35.3 80.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.933 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.77 -33.19 72.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 378' ' ' TRP . 11.7 mt -84.66 -30.46 24.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.876 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -70.85 -29.06 65.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.915 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.509 HD22 ' OE2' ' A' ' 439' ' ' GLU . 28.9 mt -57.79 158.72 11.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.31 165.47 30.35 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.639 2.226 . . . . 0.0 112.296 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.21 -33.14 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -34.95 74.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 439' ' ' GLU . . . . . 0.509 ' OE2' HD22 ' A' ' 435' ' ' LEU . 0.5 OUTLIER -74.74 -52.14 12.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.636 ' HA ' HD12 ' A' ' 443' ' ' ILE . 46.9 mtm180 -59.46 -30.54 68.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.996 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.71 -34.74 69.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.996 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -77.1 -31.55 56.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.636 HD12 ' HA ' ' A' ' 440' ' ' ARG . 7.0 mt -75.71 -40.51 40.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.053 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.493 ' CE1' HD13 ' A' ' 388' ' ' ILE . 13.0 m-85 -68.04 -29.48 68.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.07 -179.914 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.849 0.357 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.491 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -64.82 158.27 25.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.017 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.4 m -63.05 -21.41 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.11 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.6 mt-10 -53.03 -26.5 15.87 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.13 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.85 ' O ' HG23 ' A' ' 379' ' ' VAL . 6.5 tp -57.85 -42.62 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 111.132 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.584 ' CZ ' HD21 ' A' ' 426' ' ' LEU . 99.2 m-85 -70.47 -44.29 68.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -65.63 -31.34 72.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.947 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 45.6 m0 -70.57 -34.79 72.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.8 t -64.74 -37.73 80.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.031 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.8 -38.64 64.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.935 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -73.63 -34.67 65.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.949 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.9 -47.74 50.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.561 HD21 ' CB ' ' A' ' 393' ' ' PHE . 21.9 mt -59.87 -30.88 69.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -81.68 -39.16 24.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -72.81 -32.27 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -76.5 -67.72 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 106.54 58.68 0.6 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.467 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 31.8 pt -141.53 -179.71 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 0.0 111.072 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.41 154.81 17.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.786 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.839 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -58.78 -29.72 67.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.002 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.76 -47.35 86.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.161 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -51.64 49.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.15 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.561 ' CB ' HD21 ' A' ' 383' ' ' LEU . 51.6 t80 -58.41 -45.45 88.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.411 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -63.07 -30.08 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.185 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -51.38 12.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.943 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.51 -36.78 77.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.201 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -68.73 -58.34 4.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.425 ' CE1' HD12 ' A' ' 405' ' ' LEU . 20.3 p90 -150.81 111.05 4.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.097 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -75.22 119.65 19.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.59 -65.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.848 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 401' ' ' THR . . . . . 0.762 HG23 ' HB2' ' A' ' 404' ' ' LEU . 2.6 t -161.46 146.7 13.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -80.08 147.85 31.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 77.1 3.79 82.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.79 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.762 ' HB2' HG23 ' A' ' 401' ' ' THR . 12.5 tp -88.31 -29.57 20.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.87 0.366 . . . . 0.0 110.93 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.0 tt -63.66 -20.9 66.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.164 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 85.3 p -68.42 -64.93 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.202 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -53.43 -40.07 64.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.242 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 422' ' ' LEU . 41.6 mt -59.88 -33.2 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.338 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.2 mt -91.23 -30.52 16.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.876 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 15.7 ttp85 -72.67 -40.21 66.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.22 -41.31 92.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.874 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 61.09 31.75 19.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.99 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -78.72 142.61 36.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -85.36 142.58 37.97 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.5 ' HB3' HD23 ' A' ' 423' ' ' LEU . 52.6 Cg_exo -52.4 -25.66 25.41 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.528 2.152 . . . . 0.0 112.43 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -57.43 -47.25 82.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.01 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.7 p -110.42 28.75 8.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.205 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.424 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.13 -178.71 3.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.125 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 74.7 m -99.94 172.48 7.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.778 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.9 mt-30 -62.25 -34.0 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.941 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.27 -46.03 85.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.734 HD11 HG23 ' A' ' 408' ' ' ILE . 7.3 tp -65.36 -40.67 93.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.909 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 420' ' ' GLN . 31.2 mt -59.65 -35.91 75.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.817 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.5 t -78.12 -37.19 22.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.853 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -60.69 -48.48 81.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.79 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.584 HD21 ' CZ ' ' A' ' 376' ' ' TYR . 3.6 mt -65.12 -37.48 87.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.761 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.93 -41.95 97.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.96 92.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.018 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.0 mtm -60.67 -34.22 74.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.798 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -64.43 -45.76 86.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.743 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.36 -48.81 80.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.852 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.46 ' HE1' HD13 ' A' ' 443' ' ' ILE . 54.3 t80 -60.63 -31.35 70.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.832 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.34 -28.61 26.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.941 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -69.94 -34.88 74.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.21 146.89 82.54 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.64 152.4 16.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.47 2.113 . . . . 0.0 112.329 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -31.1 69.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.11 93.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.018 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.16 -40.79 74.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.85 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 28.7 mtm-85 -61.87 -38.94 90.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.828 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -66.87 -38.72 86.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -35.41 78.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.863 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.46 HD13 ' HE1' ' A' ' 432' ' ' PHE . 7.5 mt -81.68 -35.37 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.09 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.21 -34.7 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.939 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.23 0.031 0 CA-C-O 120.848 0.356 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.599 ' O ' HG22 ' A' ' 375' ' ' ILE . 4.8 m -86.52 170.25 12.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.992 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -21.74 63.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.423 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 2.5 mp0 -52.15 -28.1 16.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.216 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.6 tp -58.81 -41.54 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.066 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.433 ' N ' HG23 ' A' ' 375' ' ' ILE . 92.0 m-85 -71.09 -36.44 72.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.827 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -69.31 -36.21 76.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.423 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.0 m0 -63.24 -40.48 97.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 375' ' ' ILE . 26.2 t -58.67 -52.58 58.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -60.08 -40.6 90.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.02 -36.51 80.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.02 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.17 -46.61 61.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.03 -35.22 74.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.88 -51.28 9.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.892 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -63.72 -52.24 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.931 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.5 8.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 94.64 59.06 1.15 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.476 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 33.7 pt -138.54 165.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.334 . . . . 0.0 111.089 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.75 157.95 31.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -30.69 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.929 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.93 -36.29 76.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.287 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.49 -52.53 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.141 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -57.02 -30.89 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.68 -29.36 29.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.104 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -73.6 -46.7 45.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.958 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.56 -38.1 75.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.17 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -69.15 -57.71 5.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -153.59 105.59 2.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.845 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -73.65 97.25 2.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 23.8 mtt85 -146.21 -65.35 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.831 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 401' ' ' THR . . . . . 0.545 HG22 ' H ' ' A' ' 403' ' ' GLY . 26.3 m -154.16 117.65 4.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.075 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -60.88 -23.08 64.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.209 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 403' ' ' GLY . . . . . 0.545 ' H ' HG22 ' A' ' 401' ' ' THR . . . -91.17 17.45 55.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.875 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.481 ' HG ' HD11 ' A' ' 408' ' ' ILE . 10.0 tp -100.02 -37.85 8.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.317 . . . . 0.0 110.908 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 1.6 tp -57.92 -42.77 85.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.977 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 3.3 t -64.78 -29.51 70.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.031 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -80.15 -43.15 22.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.481 HD11 ' HG ' ' A' ' 404' ' ' LEU . 10.6 mt -67.97 -42.73 85.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.052 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 25.5 mt -66.57 -33.6 76.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.67 -38.31 73.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -65.9 -49.88 66.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.18 31.05 20.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.919 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.63 135.58 38.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -70.49 127.73 91.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.861 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.73 54.06 5.06 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.511 2.14 . . . . 0.0 112.478 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -100.03 -43.57 6.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.805 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.0 p -128.46 31.32 5.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.094 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.34 -178.31 6.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.3 p -77.27 175.05 10.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.856 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.7 mp0 -76.63 -31.44 57.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.932 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 3.2 t -59.46 -39.8 84.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.23 -40.8 64.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.72 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.845 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.856 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.4 t -60.43 -46.98 94.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.991 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -63.82 -46.42 85.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.76 -33.68 75.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.836 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -41.42 99.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.15 -49.73 76.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.994 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 6.4 ttm -66.13 -37.64 86.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -45.82 88.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -61.84 -36.74 82.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.747 ' HE1' HD13 ' A' ' 443' ' ' ILE . 17.1 t80 -68.91 -39.36 79.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.798 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.493 HD11 HG22 ' A' ' 379' ' ' VAL . 5.9 mt -78.21 -32.38 49.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -71.04 -30.71 66.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 432' ' ' PHE . 9.8 mt -58.92 159.5 13.34 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.4 147.83 90.73 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.549 2.166 . . . . 0.0 112.293 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.17 -29.98 67.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.15 -42.71 86.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.094 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.16 -42.42 65.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.483 ' HA ' HD12 ' A' ' 443' ' ' ILE . 41.6 mtm-85 -59.1 -42.22 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.68 -42.37 96.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.873 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -62.44 -50.05 73.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.747 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.6 mt -60.01 -42.62 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -65.65 -31.92 73.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.407 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 375' ' ' ILE . 13.0 m -99.62 169.38 9.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 79.6 p -63.5 -21.75 66.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.116 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 9.2 mm-40 -51.86 -27.16 11.76 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 111.211 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.712 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.1 tp -57.93 -44.88 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.167 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.592 ' OH ' HD21 ' A' ' 426' ' ' LEU . 93.1 m-85 -67.11 -43.6 82.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -67.61 -30.37 69.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.951 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 39.2 m0 -68.15 -42.05 80.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.948 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.3 t -59.53 -43.93 91.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.167 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -60.69 -57.19 13.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -46.36 89.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.29 -33.41 67.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.049 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.1 mt -71.14 -30.56 66.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.74 -35.0 24.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.53 -31.71 57.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.41 -44.95 15.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 73.92 63.98 2.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.447 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.497 HD11 ' HD2' ' A' ' 393' ' ' PHE . 41.4 pt -139.52 167.22 20.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.103 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 151.26 30.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.543 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.29 -31.77 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.828 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.47 -39.5 91.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.131 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 24.8 t -75.86 -42.35 39.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.099 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.497 ' HD2' HD11 ' A' ' 388' ' ' ILE . 24.3 t80 -60.43 -50.46 73.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.64 -31.56 72.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -62.38 1.71 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -62.93 -37.06 78.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 397' ' ' ALA . . . . . 0.481 ' O ' ' HB1' ' A' ' 428' ' ' ALA . . . -67.64 -63.78 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.127 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.458 ' HE2' HD23 ' A' ' 404' ' ' LEU . 9.6 p90 -152.03 109.48 3.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.13 94.37 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.793 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -141.92 -70.11 0.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.793 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -157.41 165.14 36.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.02 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.65 -25.16 22.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.069 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -84.48 -26.03 40.78 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.628 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 404' ' ' LEU . . . . . 0.474 ' HG ' HD11 ' A' ' 408' ' ' ILE . 26.3 tp -58.59 -45.39 89.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.543 HD22 ' CG ' ' A' ' 390' ' ' GLN . 6.2 tt -60.08 -38.29 82.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.947 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 21.4 p -69.82 -31.1 68.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.936 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.26 -40.36 64.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 376' ' ' TYR . 11.4 mt -72.09 -47.59 53.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.06 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.35 -35.79 81.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.3 -42.37 65.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -48.78 80.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 60.27 32.93 20.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.97 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -91.07 126.6 36.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.922 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.66 151.36 71.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.7 46.49 2.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.769 2.313 . . . . 0.0 112.638 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -100.18 -34.06 10.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.748 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.4 31.15 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.42 -174.85 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 419' ' ' SER . . . . . 0.483 ' O ' HD23 ' A' ' 423' ' ' LEU . 94.6 p -99.77 179.26 4.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.97 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.658 ' O ' HG23 ' A' ' 424' ' ' VAL . 49.9 tp60 -62.18 -52.27 64.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 2.7 t -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.936 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 422' ' ' LEU . 1.2 tm? -69.91 -33.9 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 419' ' ' SER . 4.2 mm? -77.69 -40.42 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.832 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -59.62 -48.98 85.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.142 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.54 -42.55 91.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.959 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.592 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.9 mp -65.05 -32.4 74.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.0 ttm105 -65.61 -40.72 92.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' A' ' 397' ' ' ALA . . . -59.82 -50.46 73.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.163 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 26.7 mtm -60.97 -34.27 74.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -70.53 -50.81 33.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.924 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.59 -35.1 75.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.529 ' HA ' HD12 ' A' ' 435' ' ' LEU . 42.0 t80 -74.33 -31.67 62.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 379' ' ' VAL . 21.3 mt -82.29 -31.32 30.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -79.23 -26.34 42.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 432' ' ' PHE . 8.9 mt -55.88 159.66 5.21 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.055 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -51.7 141.74 43.09 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.59 2.193 . . . . 0.0 112.435 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.75 -39.75 95.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.98 -32.38 73.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.49 -40.47 66.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.824 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 444' ' ' TYR . 87.5 mtm-85 -59.63 -41.05 89.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.47 -45.64 93.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -60.92 -41.8 96.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.45 -34.36 52.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.033 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 440' ' ' ARG . 10.9 m-85 -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.988 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.886 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.4 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.831 0.348 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.429 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -84.18 175.06 9.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.6 t -58.6 -21.57 53.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.202 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.7 mt-10 -52.55 -26.19 12.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.208 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.0 tp -56.98 -44.36 82.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.133 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.485 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.2 m-85 -69.72 -43.73 71.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -65.45 -31.51 72.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.606 ' HB3' HD13 ' A' ' 433' ' ' LEU . 36.0 m0 -65.49 -45.05 85.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -61.8 -38.67 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.103 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -67.83 -49.15 63.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -31.56 72.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.992 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -77.38 -31.3 54.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.986 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.89 -33.0 67.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.57 -34.39 35.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.872 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -78.53 -32.12 47.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -83.61 -56.75 3.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.94 52.47 2.24 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 4.0 pt -137.65 162.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.32 . . . . 0.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 19.7 m -74.53 150.46 39.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.686 ' HB3' HD22 ' A' ' 405' ' ' LEU . 79.1 mt-30 -60.19 -28.9 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.927 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.94 -46.4 85.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.223 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 28.8 t -69.92 -41.67 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.433 ' CE1' HG13 ' A' ' 379' ' ' VAL . 52.1 t80 -59.96 -36.58 77.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.015 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.7 -40.9 88.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -62.98 -51.8 65.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.19 -31.11 50.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.119 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.35 -76.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.566 ' HB3' ' HB3' ' A' ' 428' ' ' ALA . 7.2 p90 -126.93 117.99 23.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.71 95.5 6.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.788 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -145.18 -65.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.91 156.98 43.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.031 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -90.3 -32.85 16.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.06 26.79 19.27 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.522 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -99.98 -46.42 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.96 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.781 ' HA ' HD12 ' A' ' 408' ' ' ILE . 3.9 tt -57.89 -34.8 70.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.019 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.36 -30.88 67.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -79.42 -38.87 33.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.994 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -63.68 -51.05 75.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 405' ' ' LEU . 4.3 mm? -59.9 -38.96 83.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -37.39 83.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -63.63 -47.73 80.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 60.53 32.01 20.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.952 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.39 149.91 20.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.32 148.59 93.71 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.981 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.553 ' HB3' HD13 ' A' ' 426' ' ' LEU . 69.4 Cg_endo -74.42 -5.74 17.34 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.198 . . . . 0.0 112.602 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.61 -30.99 68.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.087 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.3 t -127.02 21.07 6.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.39 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.98 171.0 15.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 419' ' ' SER . . . . . 0.415 ' O ' HD23 ' A' ' 423' ' ' LEU . 32.9 t -74.16 172.54 11.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.767 ' O ' HG23 ' A' ' 424' ' ' VAL . 16.2 pm0 -72.72 -30.42 64.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 52.1 p -67.94 -42.4 81.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.856 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 426' ' ' LEU . 1.1 tt -67.67 -40.75 84.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.507 ' HA ' HD12 ' A' ' 426' ' ' LEU . 2.7 mm? -57.77 -32.71 67.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.5 t -72.64 -35.4 50.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.984 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.77 -43.59 68.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.647 HD11 HD22 ' A' ' 422' ' ' LEU . 11.3 mt -60.07 -33.57 72.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -62.25 -56.29 20.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.566 ' HB3' ' HB3' ' A' ' 398' ' ' PHE . . . -62.86 -32.48 73.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.104 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 12.0 mtm -71.57 -36.57 70.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -66.74 -44.62 81.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.945 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -60.07 -46.01 90.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.609 ' HA ' HD12 ' A' ' 435' ' ' LEU . 20.8 t80 -58.14 -41.26 83.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.001 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.606 HD13 ' HB3' ' A' ' 378' ' ' TRP . 7.8 mt -71.49 -27.91 63.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.002 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -80.47 -25.03 39.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.166 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 432' ' ' PHE . 48.9 mt -55.36 154.14 12.28 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.014 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.34 145.59 35.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.568 2.179 . . . . 0.0 112.328 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -63.74 -35.04 79.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.66 -37.89 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -75.22 -42.0 56.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -59.27 -40.33 85.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.09 -42.74 96.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -47.56 80.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 31.3 mt -59.55 -34.43 54.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.949 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.02 -43.25 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.723 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.975 179.917 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.904 0.383 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.765 ' O ' HG22 ' A' ' 375' ' ' ILE . 31.2 m -100.01 -174.38 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.4 t -58.15 -23.44 55.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.092 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 5.2 mm-40 -55.52 -28.66 56.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.083 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.801 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.1 tp -59.19 -32.58 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.92 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.562 ' HE2' HG22 ' A' ' 408' ' ' ILE . 82.0 m-85 -77.86 -42.86 32.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.94 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -32.73 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.944 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.1 m0 -69.03 -44.92 71.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.012 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 375' ' ' ILE . 37.0 t -61.42 -40.86 87.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.06 -30.77 61.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -45.75 48.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.962 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.36 -35.93 82.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 383' ' ' LEU . 13.3 mt -67.54 -32.91 74.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -79.54 -44.24 21.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -33.97 75.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.32 -69.1 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.071 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.32 61.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.434 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 23.8 pt -137.5 164.67 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 0.0 111.116 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 p -72.32 152.43 42.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.435 ' HG2' HD22 ' A' ' 405' ' ' LEU . 5.6 mt-30 -62.42 -31.11 71.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.27 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.4 t -79.73 -40.9 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.566 ' CE2' HG13 ' A' ' 379' ' ' VAL . 48.1 t80 -68.21 -50.33 54.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.74 -37.55 82.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 22.2 ttt-85 -60.63 -41.22 94.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.832 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.406 ' HB ' ' CE1' ' A' ' 432' ' ' PHE . 26.9 m -85.89 -30.4 6.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.84 -65.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.495 ' CE1' HD12 ' A' ' 405' ' ' LEU . 3.8 p90 -143.47 102.62 3.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -68.61 97.49 0.8 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.829 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -142.07 -70.67 0.34 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.32 143.53 16.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.061 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -77.64 125.78 29.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.974 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 112.05 -28.47 9.26 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.428 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.03 -31.4 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.763 ' HA ' HD12 ' A' ' 408' ' ' ILE . 5.8 tt -59.21 -47.47 85.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -31.41 72.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.903 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -68.45 -39.57 81.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.988 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.6 mt -64.96 -35.7 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.031 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.62 -35.16 45.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.925 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -71.33 -42.89 67.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 60.29 34.3 20.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.975 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.38 142.83 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.11 149.71 89.67 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.99 -11.37 29.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.571 2.18 . . . . 0.0 112.585 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -68.62 -38.89 80.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.361 . . . . 0.0 110.966 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -99.78 -26.87 13.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -55.58 176.38 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.243 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 43.4 t -82.76 175.93 9.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.669 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -70.7 -31.05 67.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.856 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 m -58.84 -46.6 87.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.828 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.709 HD11 HG23 ' A' ' 408' ' ' ILE . 11.5 tp -65.03 -38.91 92.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 420' ' ' GLN . 2.6 mt -59.83 -31.2 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.815 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.6 t -74.11 -47.38 42.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.065 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -63.75 -42.46 97.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.13 -35.16 74.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -63.51 -39.15 93.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.03 89.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.54 -36.84 79.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -66.34 -46.94 75.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -60.63 -52.94 62.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.64 ' HE1' HD13 ' A' ' 443' ' ' ILE . 66.6 t80 -57.46 -40.62 78.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.987 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.32 -26.42 61.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -72.82 -28.2 62.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.87 149.24 55.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.924 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.7 161.49 4.4 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.602 2.201 . . . . 0.0 112.34 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.39 -31.51 72.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.08 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -71.01 -42.83 69.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.409 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 78.1 mtm-85 -64.56 -42.87 95.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.07 -34.44 78.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -67.35 -47.4 70.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.837 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.64 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.4 mt -63.57 -47.26 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 21.2 m-85 -60.77 -34.2 74.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.862 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.311 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.871 0.367 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.5 m -97.07 177.51 5.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.951 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 39.7 t -66.2 -15.47 63.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.17 -29.35 21.88 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.082 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.5 tp -59.87 -40.18 82.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.432 ' CD1' HG23 ' A' ' 375' ' ' ILE . 86.5 m-85 -70.97 -38.3 72.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -71.49 -31.35 67.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.432 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 44.2 m0 -65.48 -44.44 87.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.791 HG13 ' CE1' ' A' ' 393' ' ' PHE . 22.0 t -68.64 -43.11 83.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.074 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 34.5 mtt180 -60.38 -44.62 95.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.87 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -69.46 -37.23 77.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -43.68 94.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 59.4 mt -60.41 -38.2 83.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.833 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -78.36 -31.82 48.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 11.5 mtt-85 -64.87 -65.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -74.12 -30.87 62.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.181 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 76.52 45.82 13.13 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.522 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 27.7 pt -108.11 165.07 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.82 0.343 . . . . 0.0 111.179 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 43.8 m -81.67 154.03 26.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.515 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.0 mt-30 -60.39 -29.2 68.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.995 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.97 -45.09 87.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.504 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.2 t -70.66 -49.9 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.791 ' CE1' HG13 ' A' ' 379' ' ' VAL . 37.5 t80 -61.87 -41.02 97.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.9 70.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.161 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -48.18 16.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.924 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.7 m -73.79 -29.1 25.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.225 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.78 -60.96 2.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.131 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 398' ' ' PHE . . . . . 0.546 ' CD2' ' ND2' ' A' ' 425' ' ' ASN . 16.1 p90 -146.89 105.88 3.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -74.29 100.67 3.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.35 -69.38 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.2 p -153.03 134.04 14.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.156 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.47 139.75 45.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 99.35 -24.59 31.6 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.581 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.6 tp -62.75 -36.16 82.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.515 HD22 ' HG2' ' A' ' 390' ' ' GLN . 9.1 tt -58.56 -46.85 86.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.028 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -28.85 66.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.965 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -78.71 -41.68 30.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 422' ' ' LEU . 19.3 mt -65.7 -38.9 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 409' ' ' LEU . 13.5 mt -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.982 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -69.45 -31.42 69.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 20.3 mttp -85.2 -45.84 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 61.28 31.95 19.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.814 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.24 169.96 9.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.08 130.37 26.31 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.832 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.639 ' HG3' HD13 ' A' ' 426' ' ' LEU . 52.2 Cg_exo -52.66 -25.92 27.9 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.465 2.11 . . . . 0.0 112.364 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -58.13 -33.75 69.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.999 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 8.9 t -111.32 -19.82 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.353 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -53.78 173.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.9 0.381 . . . . 0.0 111.311 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 53.0 m -81.25 -179.78 7.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.751 ' HA ' HD12 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -72.74 -36.93 67.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.846 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -46.23 88.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.879 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.745 HD11 HG23 ' A' ' 408' ' ' ILE . 3.2 tp -61.83 -39.9 93.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.751 HD12 ' HA ' ' A' ' 420' ' ' GLN . 13.2 mt -59.07 -32.88 70.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.738 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 420' ' ' GLN . 22.2 t -77.67 -34.91 20.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.04 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 425' ' ' ASN . . . . . 0.546 ' ND2' ' CD2' ' A' ' 398' ' ' PHE . 5.9 m120 -72.37 -47.32 50.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.918 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.639 HD13 ' HG3' ' A' ' 415' ' ' PRO . 25.1 mt -61.57 -34.89 76.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.785 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.3 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.79 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.49 87.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.989 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.1 mtp -64.79 -35.67 81.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.808 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -62.86 -45.9 90.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.763 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -61.95 -42.96 99.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.812 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.476 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.1 t80 -63.03 -44.05 97.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.77 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.42 HD13 ' HB3' ' A' ' 378' ' ' TRP . 22.6 mt -71.58 -25.82 62.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.041 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -69.88 -29.38 66.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.95 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 60.3 mt -58.94 154.81 36.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.968 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.27 162.87 38.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.624 2.216 . . . . 0.0 112.275 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -59.63 -37.21 78.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.74 -38.93 92.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.08 -41.77 58.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.488 ' HA ' HD12 ' A' ' 443' ' ' ILE . 66.8 mtm180 -59.81 -45.82 91.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -62.44 -39.06 92.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -62.81 -35.55 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 440' ' ' ARG . 8.7 mt -76.48 -34.12 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.06 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -66.16 -54.07 29.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.955 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 371' ' ' VAL . . . . . 0.648 HG11 HD23 ' A' ' 426' ' ' LEU . 21.8 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.803 0.335 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.787 ' O ' HG22 ' A' ' 375' ' ' ILE . 0.9 OUTLIER -100.04 -175.22 2.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -23.95 63.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.119 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.02 -28.55 62.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.787 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -58.01 -35.73 53.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.146 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -76.65 -40.36 49.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.864 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -69.46 -30.97 68.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.794 ' HB3' HD13 ' A' ' 433' ' ' LEU . 49.9 m0 -67.79 -43.07 80.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.952 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -58.82 -44.55 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.129 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -72.18 -49.11 38.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.975 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.9 -30.53 69.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.992 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -80.91 -38.49 27.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.995 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 HG13 ' A' ' 388' ' ' ILE . 7.1 mt -64.95 -40.41 94.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.969 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 -32.14 65.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.995 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.51 -31.35 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.06 -52.82 6.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 88.15 72.09 1.28 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.502 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.54 HD13 ' CE1' ' A' ' 444' ' ' TYR . 21.4 pt -148.77 173.59 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 111.158 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 3.2 m -90.41 152.6 20.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.5 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.57 -30.82 70.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.862 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.64 98.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.127 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.587 ' O ' HG22 ' A' ' 396' ' ' VAL . 32.8 t -70.61 -48.21 59.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.161 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -58.28 -48.65 79.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.416 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -60.53 -30.71 69.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -76.0 -55.28 5.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.867 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 392' ' ' VAL . 23.9 m -67.04 -27.91 41.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.211 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -77.4 -73.85 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -128.92 113.08 14.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -78.8 90.54 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 400' ' ' ARG . . . . . 0.621 ' O ' HG23 ' A' ' 401' ' ' THR . 7.4 tpt180 -132.77 -66.19 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 401' ' ' THR . . . . . 0.621 HG23 ' O ' ' A' ' 400' ' ' ARG . 1.0 OUTLIER -163.84 155.67 16.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 8.3 tm0? -85.19 137.69 32.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.7 -27.57 17.2 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.78 -31.49 69.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 110.932 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.613 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.7 tt -60.44 -48.46 81.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 9.5 m -61.54 -38.66 88.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -40.68 90.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.002 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.4 mt -67.7 -37.28 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.118 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 91.9 mt -79.22 -27.69 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.998 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.68 -31.01 64.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -69.05 -42.81 75.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 61.25 27.59 17.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.979 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.0 161.6 13.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.864 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.0 142.78 25.26 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.979 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 49.9 Cg_exo -54.85 -19.86 20.6 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.38 2.053 . . . . 0.0 112.584 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -49.17 -27.98 4.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.327 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 p -125.02 20.95 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.453 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -100.19 -173.02 2.32 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.05 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.05 178.66 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.752 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 423' ' ' LEU . 1.1 tp-100 -70.03 -31.03 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 22.6 t -58.94 -49.94 75.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 18.2 tp -62.08 -38.32 88.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 420' ' ' GLN . 50.0 mt -59.63 -30.81 68.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.815 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -71.98 -50.12 39.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.204 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -60.55 -44.04 96.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.648 HD23 HG11 ' A' ' 371' ' ' VAL . 7.9 mp -65.68 -31.54 72.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.22 -51.37 69.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.16 70.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -44.29 78.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 430' ' ' GLN . . . . . 0.429 ' HB2' HD13 ' A' ' 375' ' ' ILE . 8.5 tt0 -64.08 -44.96 90.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -60.36 -40.83 92.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.54 ' HA ' HD12 ' A' ' 435' ' ' LEU . 44.2 t80 -66.09 -33.6 76.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.785 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.794 HD13 ' HB3' ' A' ' 378' ' ' TRP . 13.4 mt -83.74 -27.74 28.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.998 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -74.9 -28.18 60.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.984 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.0 OUTLIER -56.92 161.89 4.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 436' ' ' PRO . . . . . 0.516 ' HD2' HD23 ' A' ' 435' ' ' LEU . 41.5 Cg_endo -67.33 148.39 79.74 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.513 2.142 . . . . 0.0 112.32 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.46 -31.29 69.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.963 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -46.07 90.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -45.16 68.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.961 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -58.19 -36.86 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.29 -37.58 87.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.811 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -75.0 -34.59 61.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.823 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 443' ' ' ILE . 9.8 mt -75.75 -10.88 13.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.459 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.54 ' CE1' HD13 ' A' ' 388' ' ' ILE . 4.8 m-85 -95.76 -29.63 14.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.436 -179.82 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.841 0.353 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 375' ' ' ILE . 5.0 m -99.8 163.1 12.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.2 t -66.31 -20.88 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.6 -27.53 11.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 111.199 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.7 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.9 tp -58.02 -44.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.109 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.591 ' HE1' HG22 ' A' ' 408' ' ' ILE . 76.9 m-85 -66.85 -40.83 88.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -66.91 -32.35 73.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.413 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.6 m0 -69.07 -46.75 67.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.933 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -60.53 -33.3 53.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.028 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -74.13 -43.55 57.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.813 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.21 -35.55 71.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.833 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.77 -36.49 78.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.891 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -35.83 79.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.851 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -72.46 -38.85 68.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -43.95 57.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.828 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.73 -32.02 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 64.54 30.81 78.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.512 HD13 ' CE1' ' A' ' 444' ' ' TYR . 42.6 pt -102.45 162.19 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.745 0.307 . . . . 0.0 111.154 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.42 151.78 42.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.57 ' HB3' HD22 ' A' ' 405' ' ' LEU . 52.8 mt-30 -62.76 -31.67 72.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.09 96.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.02 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -70.9 -43.12 77.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -61.99 -44.78 96.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.5 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -65.33 -30.56 71.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.138 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -72.86 -35.33 67.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -87.99 -31.48 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 397' ' ' ALA . . . . . 0.421 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -78.53 -63.03 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.086 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -140.12 98.42 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 97.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.919 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -136.37 -67.0 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 66.8 p -156.37 147.38 22.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.092 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.9 136.85 38.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 98.26 -27.42 19.43 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 9.8 tp -59.4 -36.03 75.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 409' ' ' LEU . 10.0 tt -59.88 -31.07 69.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.959 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 54.3 m -74.99 -44.92 45.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.98 -41.04 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.591 HG22 ' HE1' ' A' ' 376' ' ' TYR . 13.6 mt -69.38 -32.27 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.008 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.8 mm? -81.55 -30.67 33.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -44.1 61.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -45.52 91.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.952 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.99 31.3 19.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.34 151.72 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.05 146.57 63.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.94 -27.31 14.41 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.524 2.15 . . . . 0.0 112.405 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -58.39 -33.06 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.975 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 24.9 p -114.88 27.24 9.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.207 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.06 -169.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 18.5 m -99.59 173.13 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.884 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.6 mm100 -62.79 -47.58 82.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 6.3 p -59.31 -39.82 84.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.738 HD13 ' O ' ' A' ' 422' ' ' LEU . 3.2 tm? -68.82 -34.58 75.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.887 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.66 -35.43 67.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 420' ' ' GLN . 24.1 t -65.69 -47.41 86.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.028 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -65.54 -37.65 87.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.93 -35.28 78.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.37 -44.9 95.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.12 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.043 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 429' ' ' MET . . . . . 0.421 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 2.6 mtm -64.78 -36.37 84.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.863 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 430' ' ' GLN . . . . . 0.455 ' HG3' HD13 ' A' ' 375' ' ' ILE . 15.2 tt0 -67.95 -42.87 80.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.28 -40.95 97.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.468 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.9 t80 -62.97 -35.7 81.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.845 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 378' ' ' TRP . 11.3 mt -79.49 -26.63 41.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.934 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -70.0 -28.28 65.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.928 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.423 HD13 ' OE1' ' A' ' 439' ' ' GLU . 80.0 mt -57.98 155.3 24.67 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.97 163.5 35.46 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.559 2.173 . . . . 0.0 112.286 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -59.58 -31.47 69.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.52 75.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.192 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 439' ' ' GLU . . . . . 0.423 ' OE1' HD13 ' A' ' 435' ' ' LEU . 4.5 mm-40 -75.35 -51.61 12.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.406 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 6.2 mtp180 -58.76 -38.64 78.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.905 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.1 -47.99 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.951 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -39.8 77.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.033 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.468 HD13 ' HE1' ' A' ' 432' ' ' PHE . 18.0 mt -73.07 -45.36 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.14 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.512 ' CE1' HD13 ' A' ' 388' ' ' ILE . 16.2 m-85 -62.96 -49.95 72.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.951 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 371' ' ' VAL . . . . . 0.429 ' HB ' ' HG3' ' A' ' 415' ' ' PRO . 7.9 t . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.701 0.286 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.596 ' O ' HG22 ' A' ' 375' ' ' ILE . 67.5 m -62.78 -177.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.003 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.4 m -66.93 -22.35 65.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.054 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 374' ' ' GLU . . . . . 0.435 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 36.5 mt-10 -51.02 -27.39 7.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.175 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.639 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.4 tp -59.58 -44.89 94.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.575 ' HE1' HG22 ' A' ' 408' ' ' ILE . 88.5 m-85 -65.74 -36.87 84.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.04 -31.01 68.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.435 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.1 m0 -72.05 -45.91 58.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 379' ' ' VAL . . . . . 0.779 HG22 HD11 ' A' ' 433' ' ' LEU . 30.4 t -60.47 -33.57 54.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.033 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -69.3 -41.25 77.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -37.0 50.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.951 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -61.21 -39.14 89.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.963 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 26.8 mt -74.14 -32.2 63.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.21 -31.56 62.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.967 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 16.0 mmt85 -77.96 -62.2 1.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.35 84.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.111 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 69.82 64.39 2.94 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.448 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.452 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 25.2 pt -131.56 157.28 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.759 0.314 . . . . 0.0 111.181 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 389' ' ' SER . . . . . 0.666 ' OG ' HG23 ' A' ' 392' ' ' VAL . 4.9 p -65.0 157.07 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 390' ' ' GLN . . . . . 0.433 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -68.13 -34.55 76.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.872 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.71 -30.88 69.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.108 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.666 HG23 ' OG ' ' A' ' 389' ' ' SER . 30.0 t -77.1 -50.66 20.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 393' ' ' PHE . . . . . 0.414 ' HA ' HG22 ' A' ' 396' ' ' VAL . 16.2 t80 -64.68 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.65 -41.79 87.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.167 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -47.65 70.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.847 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 392' ' ' VAL . 35.7 m -69.43 -37.89 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.186 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -72.27 -70.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -134.49 113.28 11.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.857 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -60.34 96.54 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.86 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -147.79 178.82 8.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.759 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.01 151.0 46.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -67.95 149.24 50.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.946 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.29 -27.72 15.92 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.542 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.87 -34.09 74.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.834 0.35 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 408' ' ' ILE . 4.3 tt -59.76 -50.44 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.8 p -60.27 -30.64 69.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -71.49 -33.22 69.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.957 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.9 mt -77.2 -36.25 24.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.489 HD23 HD23 ' A' ' 405' ' ' LEU . 4.0 mm? -74.09 -35.18 64.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -55.66 5.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -60.07 -48.41 81.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.878 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 60.13 30.96 20.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.989 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.8 115.68 6.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.49 149.17 84.64 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.429 ' HG3' ' HB ' ' A' ' 371' ' ' VAL . 94.1 Cg_endo -83.49 47.36 2.33 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.844 2.363 . . . . 0.0 112.823 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -100.15 -50.87 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 0.0 110.91 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.11 30.7 6.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -90.84 -177.48 4.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.087 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 419' ' ' SER . . . . . 0.6 ' O ' HD23 ' A' ' 423' ' ' LEU . 0.3 OUTLIER -87.5 178.58 6.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 179.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.893 ' O ' HG23 ' A' ' 424' ' ' VAL . 74.3 mt-30 -75.14 -30.22 60.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.964 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -50.5 73.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.089 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 56.0 tp -64.72 -41.43 95.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 419' ' ' SER . 3.7 mm? -58.65 -38.87 79.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 420' ' ' GLN . 32.2 t -67.52 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -42.33 54.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.786 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.18 -42.3 99.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.795 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -60.53 -40.92 93.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.29 99.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.063 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.9 mtm -70.14 -34.93 73.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.822 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -69.02 -47.09 66.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.715 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -59.64 -37.59 79.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.503 ' HA ' HD12 ' A' ' 435' ' ' LEU . 3.5 t80 -67.88 -44.55 76.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 433' ' ' LEU . . . . . 0.779 HD11 HG22 ' A' ' 379' ' ' VAL . 18.2 mt -72.49 -33.22 66.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.811 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -69.89 -31.61 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.786 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 432' ' ' PHE . 14.3 mt -59.15 159.86 13.6 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.49 148.29 87.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.464 2.109 . . . . 0.0 112.32 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.7 -30.03 67.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.994 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -57.82 -40.48 80.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.119 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -51.81 23.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.448 ' HA ' HD12 ' A' ' 443' ' ' ILE . 86.7 mtm-85 -59.72 -30.79 69.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -55.54 31.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.932 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.76 -43.99 97.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.976 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.481 HD13 ' HE1' ' A' ' 432' ' ' PHE . 24.4 mt -58.93 -30.68 43.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.048 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.452 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 15.0 m-85 -87.47 -38.25 16.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.832 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 -179.923 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 30.8 t . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.849 0.357 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 375' ' ' ILE . 1.6 m -95.1 -176.69 3.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.951 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 66.4 m -66.61 -20.92 66.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.222 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -51.74 -29.62 19.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.877 0.37 . . . . 0.0 111.167 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 372' ' ' SER . 1.0 OUTLIER -59.43 -44.23 92.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.11 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 376' ' ' TYR . . . . . 0.476 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.9 m-85 -62.93 -48.77 77.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -32.25 68.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.754 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 54.4 m0 -64.1 -48.62 75.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.086 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 23.2 t -57.27 -42.12 79.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.353 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -60.58 -44.19 96.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -73.4 -41.84 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -42.37 95.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.048 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 383' ' ' LEU . 15.0 mt -60.32 -49.47 77.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.861 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -70.03 -37.89 75.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -67.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.04 -45.34 93.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.191 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 84.92 72.88 1.28 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.429 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 388' ' ' ILE . . . . . 0.421 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 19.5 pt -148.41 156.17 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.833 0.349 . . . . 0.0 111.127 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.01 152.96 42.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.895 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.34 -30.07 69.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.868 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -58.52 -38.19 77.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.144 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 392' ' ' VAL . . . . . 0.626 ' O ' HG22 ' A' ' 396' ' ' VAL . 30.2 t -77.9 -50.51 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.006 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -58.2 -35.02 71.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.014 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.76 61.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.087 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -31.26 41.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 396' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.8 m -89.0 -27.9 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.181 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -76.58 -61.6 1.91 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -146.13 119.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.894 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -76.45 101.4 5.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.29 -65.9 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.65 155.78 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.054 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.09 -32.98 39.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.945 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.29 27.16 18.14 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.56 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 13.6 tp -100.09 -38.17 8.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 405' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 409' ' ' LEU . 2.1 tt -59.47 -33.71 71.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 30.8 t -76.73 -31.58 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.889 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.4 -35.61 75.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 408' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 405' ' ' LEU . 9.9 mt -69.85 -40.49 78.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 409' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 405' ' ' LEU . 4.7 mt -75.98 -31.01 58.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.898 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -71.01 -37.9 72.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.35 -39.48 78.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 61.06 29.73 19.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 136.62 32.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.21 147.23 37.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 415' ' ' PRO . . . . . 0.561 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 51.3 Cg_exo -52.86 -23.48 21.05 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.415 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -54.64 -29.78 53.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.065 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -130.86 19.75 5.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.297 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 418' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -91.13 163.64 14.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.196 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 3.1 p -80.02 -178.12 6.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.84 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 420' ' ' GLN . . . . . 0.459 ' O ' HG23 ' A' ' 424' ' ' VAL . 6.5 tt0 -69.42 -43.89 72.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 15.8 m -58.51 -34.15 70.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 422' ' ' LEU . . . . . 0.696 HD13 ' O ' ' A' ' 422' ' ' LEU . 2.9 tm? -71.88 -38.13 70.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 35.8 mt -64.68 -40.4 95.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 424' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 420' ' ' GLN . 42.3 t -66.38 -46.12 87.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.05 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -60.52 -41.5 94.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.48 -33.82 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.975 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -60.86 -44.47 96.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.82 76.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.0 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.5 ttm -68.05 -43.09 79.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -60.68 -47.97 83.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 432' ' ' PHE . . . . . 0.545 ' HA ' HD12 ' A' ' 435' ' ' LEU . 22.9 t80 -61.43 -41.6 97.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 42.1 mt -73.71 -28.38 61.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.022 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -69.97 -38.85 76.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 5.9 mt -60.7 145.27 88.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.059 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.12 164.72 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.574 2.183 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.72 -33.41 75.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.48 81.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.021 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -50.5 41.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.715 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 440' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 88.2 mtm-85 -57.75 -36.02 71.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.784 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -54.16 49.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.09 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 10.0 mtp-105 -58.86 -47.87 83.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 443' ' ' ILE . . . . . 0.523 HD12 ' HE1' ' A' ' 432' ' ' PHE . 56.0 mt -60.27 -28.74 42.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 444' ' ' TYR . . . . . 0.421 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.9 m-85 -72.91 -44.21 61.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.476 -179.954 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.831 0.348 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.1 m -145.97 30.99 1.04 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.16 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.03 176.89 4.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 371' ' ' VAL . . . . . 0.473 HG12 ' HG2' ' A' ' 415' ' ' PRO . 21.5 t -78.94 101.63 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.098 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.1 m -100.02 179.39 4.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.9 -19.37 65.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.199 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.0 mt-10 -51.7 -27.13 10.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.202 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.568 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.3 tp -57.7 -43.65 84.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.998 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.469 ' N ' HG23 ' A' ' 375' ' ' ILE . 96.6 m-85 -72.06 -38.16 69.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.785 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -32.95 73.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.427 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.7 m0 -65.07 -43.91 90.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -58.53 -41.11 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.62 -37.21 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.56 -39.44 62.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.72 -36.68 81.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.07 -37.42 72.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -78.12 -31.4 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -53.46 7.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.931 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -67.39 -47.08 71.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 82.55 61.03 2.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.506 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.629 HD13 ' CE1' ' A' ' 444' ' ' TYR . 22.8 pt -134.46 166.2 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.813 0.339 . . . . 0.0 111.153 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.46 157.31 34.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -64.1 -31.45 72.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 391' ' ' ALA . . . . . 0.413 ' HB2' ' OE1' ' A' ' 402' ' ' GLN . . . -60.63 -35.95 77.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.076 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 396' ' ' VAL . 23.3 t -75.33 -56.56 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.068 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.421 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -59.1 -30.53 68.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -76.75 -29.93 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.268 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -81.55 -31.07 32.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.985 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.8 m -88.47 -27.15 5.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.274 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -80.35 -52.43 7.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.072 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.454 ' HE1' HD12 ' A' ' 405' ' ' LEU . 3.0 p90 -154.92 89.26 1.22 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.886 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.55 120.34 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 400' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 401' ' ' THR . 0.3 OUTLIER -161.91 -72.14 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.819 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 401' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.3 OUTLIER -164.29 129.97 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.051 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 402' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 391' ' ' ALA . 0.5 OUTLIER -63.46 151.43 41.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.822 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.46 -28.01 14.98 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.458 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.468 ' HG ' HD11 ' A' ' 408' ' ' ILE . 12.7 tp -66.52 -39.81 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.861 0.362 . . . . 0.0 110.939 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.521 HD21 HD12 ' A' ' 409' ' ' LEU . 7.4 tt -58.74 -29.48 66.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.029 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.9 t -68.93 -43.0 75.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -69.74 -37.46 76.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.654 HG23 HD21 ' A' ' 422' ' ' LEU . 16.4 mt -69.37 -34.08 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.232 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.521 HD12 HD21 ' A' ' 405' ' ' LEU . 3.4 mt -81.59 -31.81 32.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -66.31 -48.65 69.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.835 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -67.87 -47.58 68.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.95 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 61.21 30.0 19.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.6 136.39 55.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -74.22 144.35 81.52 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.473 ' HG2' HG12 ' A' ' 371' ' ' VAL . 52.7 Cg_exo -52.66 -27.35 33.04 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.565 2.177 . . . . 0.0 112.231 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -38.14 77.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.974 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 m -120.73 30.55 6.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 167.41 10.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 37.5 m -85.38 175.02 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.857 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.531 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.9 mt-30 -62.74 -51.28 67.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.86 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 4.0 t -59.3 -30.82 68.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.654 HD21 HG23 ' A' ' 408' ' ' ILE . 2.7 tm? -71.42 -44.18 65.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.17 -36.99 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.945 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -69.5 -33.07 55.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.241 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.54 -48.16 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 422' ' ' LEU . 16.1 mt -68.24 -32.74 73.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -43.64 97.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.956 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -70.85 -40.22 72.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.143 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.4 mtt -63.42 -31.4 72.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.939 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -70.23 -46.66 64.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -60.19 -35.91 76.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.37 -38.13 77.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.93 -31.69 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -72.75 -29.6 63.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.35 159.87 10.78 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.89 151.76 73.79 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.626 2.217 . . . . 0.0 112.311 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.06 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.79 -38.77 79.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.46 -48.13 51.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 42.3 mtm180 -59.48 -34.07 72.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.932 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -64.57 -41.14 96.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.6 -33.6 74.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.87 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 20.4 mt -77.51 -40.63 28.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.068 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.629 ' CE1' HD13 ' A' ' 388' ' ' ILE . 9.5 m-85 -66.19 -35.34 80.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.962 0.41 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -74.35 -61.36 1.89 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.878 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.23 104.46 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.942 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -131.14 -46.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -91.03 64.65 5.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.34 -40.67 87.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.905 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.63 52.7 2.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.878 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.51 106.01 0.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.571 HD23 ' H ' ' A' ' 452' ' ' LEU . 0.5 OUTLIER -70.46 171.0 10.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -123.48 147.36 47.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.849 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -89.93 117.56 28.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.158 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.126 179.911 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -151.1 -52.83 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.224 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -128.32 121.73 29.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.28 116.82 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.135 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.697 ' O ' HG22 ' A' ' 375' ' ' ILE . 64.3 m -86.29 173.01 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.935 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 55.0 m -62.18 -24.11 67.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.123 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -53.28 -27.65 23.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.781 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.9 tp -57.99 -37.49 61.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.051 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.443 ' OH ' HD21 ' A' ' 426' ' ' LEU . 88.8 m-85 -75.69 -42.69 50.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.887 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.85 -31.15 72.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.927 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.403 ' HB3' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -71.01 -44.28 66.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 375' ' ' ILE . 29.5 t -59.48 -33.87 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -76.46 -45.52 30.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -67.4 -40.24 85.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.004 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -31.69 70.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.982 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.4 mt -71.11 -32.03 68.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.979 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.36 -31.18 17.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.919 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -80.13 -32.9 38.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -80.32 -53.29 6.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.102 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 93.64 59.32 1.21 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.511 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.447 HD13 ' CE1' ' A' ' 444' ' ' TYR . 16.7 pt -140.34 179.23 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.918 0.389 . . . . 0.0 111.067 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.09 149.76 21.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.99 -29.6 65.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.051 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.4 -49.0 79.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.873 ' O ' HG22 ' A' ' 396' ' ' VAL . 25.3 t -66.28 -50.53 67.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.127 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.526 ' CE1' HG13 ' A' ' 379' ' ' VAL . 14.0 t80 -57.78 -30.98 66.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.019 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.47 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -82.77 -30.28 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.72 -31.24 36.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.91 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.873 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.6 m -86.05 -30.03 6.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.198 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.25 -43.14 24.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.086 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.443 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 14.3 p90 -166.98 111.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.74 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.53 124.82 20.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 400' ' ' ARG . . . . . 0.409 ' N ' ' HD3' ' A' ' 400' ' ' ARG . 0.0 OUTLIER -160.74 -177.42 6.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.954 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -84.2 144.38 29.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.029 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.5 139.27 55.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 105.11 -27.61 17.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.502 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.422 ' HG ' HD11 ' A' ' 408' ' ' ILE . 4.8 tp -64.08 -55.88 18.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 408' ' ' ILE . 0.5 OUTLIER -59.02 -32.81 70.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.966 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.18 -30.49 68.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.851 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -39.22 21.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 405' ' ' LEU . 10.1 mt -65.61 -34.58 71.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 8.4 mt -78.74 -31.47 46.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.786 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -72.5 -44.29 62.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -60.23 -49.39 77.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.856 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.44 31.23 20.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.906 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -85.12 151.12 24.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.91 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.52 144.14 80.31 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.13 -4.32 15.21 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.529 2.153 . . . . 0.0 112.673 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -56.86 -46.39 81.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.747 0.308 . . . . 0.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 p -109.29 31.67 5.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.167 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.79 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -99.99 164.55 11.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.18 174.19 11.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.834 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.664 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -64.8 -39.35 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.2 p -58.73 -41.02 85.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.79 HD23 ' CB ' ' A' ' 418' ' ' ALA . 19.8 tp -69.04 -31.24 69.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.879 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.21 -44.51 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.8 t -59.7 -43.73 92.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -67.98 -44.72 76.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.443 HD21 ' OH ' ' A' ' 376' ' ' TYR . 6.8 mp -67.1 -39.84 86.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.946 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -60.44 -41.1 93.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.867 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.102 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.36 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.43 -38.04 71.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.809 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.53 -42.91 95.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.563 ' HA ' HD12 ' A' ' 435' ' ' LEU . 24.3 t80 -62.37 -46.42 88.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 378' ' ' TRP . 34.0 mt -65.53 -29.74 70.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.01 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -70.06 -29.62 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.936 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 432' ' ' PHE . 35.9 mt -58.49 147.9 67.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.86 158.76 5.91 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.576 2.184 . . . . 0.0 112.224 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.53 -31.46 72.68 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.894 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -68.28 -35.1 77.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -75.44 -39.57 58.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.906 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -59.75 -42.17 92.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.53 81.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -42.04 90.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.87 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 29.6 mt -74.76 -29.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.203 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.447 ' CE1' HD13 ' A' ' 388' ' ' ILE . 5.9 m-85 -69.51 -46.59 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.887 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.83 -42.7 48.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.959 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.91 127.23 34.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 447' ' ' GLU . . . . . 0.763 ' OE2' HG13 ' A' ' 392' ' ' VAL . 2.3 mt-10 -152.31 -46.87 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.875 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -97.1 -28.59 14.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.016 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.96 -0.33 38.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.556 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.95 -29.28 67.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.759 0.314 . . . . 0.0 110.909 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 83.3 p -59.0 114.46 2.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.894 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 452' ' ' LEU . 0.2 OUTLIER -114.56 -65.63 1.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.852 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -120.19 153.2 36.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -99.48 -35.55 9.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.167 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.082 179.978 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 4.6 m120 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.849 0.356 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 66.3 p -59.59 167.17 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.089 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -118.5 164.06 15.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 371' ' ' VAL . . . . . 0.614 HG11 HD23 ' A' ' 426' ' ' LEU . 21.3 t -95.63 98.92 8.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.025 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.566 ' O ' HG22 ' A' ' 375' ' ' ILE . 18.1 m -94.95 -178.44 4.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.014 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -19.72 64.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.093 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -54.0 -27.9 34.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.214 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.662 ' O ' HG23 ' A' ' 379' ' ' VAL . 0.9 OUTLIER -58.57 -39.32 75.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.123 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.497 ' CD1' HG23 ' A' ' 375' ' ' ILE . 34.3 m-85 -76.63 -34.36 58.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.995 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -30.82 63.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.0 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -68.34 -46.61 69.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.28 -39.66 79.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.172 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -68.97 -39.02 79.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -74.46 -32.48 62.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.907 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -71.03 -47.85 56.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.59 -34.28 73.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -69.87 -31.71 69.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -44.05 17.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.95 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -68.79 -55.01 12.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.085 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.9 31.61 9.13 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 17.2 pt -109.86 164.02 6.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.81 0.338 . . . . 0.0 111.09 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 152.4 41.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -31.11 69.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.91 96.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.134 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.5 t -63.41 -51.9 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -61.68 -31.15 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -74.63 -32.19 62.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.9 ttt85 -72.26 -42.44 65.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.942 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.4 m -78.03 -33.7 18.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.19 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.86 -72.24 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.11 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.491 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 3.3 p90 -131.79 114.57 14.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.32 88.8 3.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.923 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -143.92 -74.62 0.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 36.9 p -148.7 171.02 16.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.0 -33.36 10.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.991 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.89 -27.47 72.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.623 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' ' 408' ' ' ILE . 33.3 tp -60.84 -46.02 92.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 394' ' ' ALA . 5.7 tt -56.95 -32.09 65.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.062 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -29.69 40.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.86 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -31.87 59.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.031 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.699 HD11 ' HG ' ' A' ' 404' ' ' LEU . 8.0 mt -73.56 -45.08 52.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.091 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.16 -44.62 62.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.045 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -62.4 -30.72 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.983 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -82.5 -44.51 15.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 61.55 30.51 18.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -86.97 164.86 16.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.786 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -93.18 151.97 40.87 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.39 -22.2 29.53 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.598 2.199 . . . . 0.0 112.457 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -29.95 60.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.155 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 67.9 p -100.91 -31.0 11.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.756 ' CB ' HD13 ' A' ' 422' ' ' LEU . . . -60.37 171.15 1.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.05 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.18 171.76 13.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.91 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.489 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.4 tt0 -59.77 -31.74 69.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 p -58.75 -45.88 88.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.756 HD13 ' CB ' ' A' ' 418' ' ' ALA . 4.8 tt -62.55 -37.53 86.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.98 -31.81 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.782 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -71.25 -44.08 73.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.199 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -73.8 -43.6 58.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.703 HD13 HD21 ' A' ' 422' ' ' LEU . 3.8 tp -60.65 -49.2 78.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.911 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -32.18 70.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.724 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.96 92.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.972 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 429' ' ' MET . . . . . 0.451 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 41.1 mtt -62.5 -42.11 99.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -64.54 -41.3 96.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.836 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -60.31 -52.61 64.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.938 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 443' ' ' ILE . 19.9 t80 -59.23 -46.27 88.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.74 -31.54 72.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.891 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -71.16 -28.37 64.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.018 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 82.9 mt -57.1 153.06 26.33 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.971 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.87 146.87 27.11 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.606 2.204 . . . . 0.0 112.386 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -64.76 -34.01 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.886 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.66 75.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.108 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -51.1 17.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.871 ' HA ' HD12 ' A' ' 443' ' ' ILE . 78.7 mtm180 -58.92 -29.48 67.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -46.92 69.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.171 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -65.75 -29.34 69.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.067 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 440' ' ' ARG . 11.2 mt -73.03 -36.78 51.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.87 0.367 . . . . 0.0 111.026 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -71.38 -31.67 67.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.917 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -79.25 -45.94 18.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.72 119.05 6.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.03 -43.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.017 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -98.46 178.7 4.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -89.42 7.37 36.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.379 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.84 29.22 3.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.715 0.293 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.97 106.21 17.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.815 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.588 HD23 ' N ' ' A' ' 452' ' ' LEU . 1.8 pt? -143.93 -175.88 4.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.911 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -126.48 112.59 15.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.966 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -71.57 178.43 3.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.151 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.084 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 368' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 369' ' ' THR . 3.7 t-20 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.843 0.354 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 369' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 368' ' ' ASN . 1.1 p -156.21 31.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.44 140.08 57.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 27.7 t -108.64 102.08 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.685 ' O ' HG22 ' A' ' 375' ' ' ILE . 14.4 m -86.55 -174.96 5.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 63.4 p -71.88 -23.96 61.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.037 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.6 mt-10 -54.18 -27.2 32.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.139 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.685 HG22 ' O ' ' A' ' 372' ' ' SER . 8.3 tp -57.9 -40.95 78.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.138 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.418 ' N ' HG23 ' A' ' 375' ' ' ILE . 93.7 m-85 -73.93 -34.13 64.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -71.65 -33.07 68.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.421 ' HB3' HD22 ' A' ' 433' ' ' LEU . 53.9 m0 -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 375' ' ' ILE . 31.8 t -60.26 -47.6 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.066 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -40.85 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.803 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.25 -34.7 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.925 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.94 -41.92 73.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 383' ' ' LEU . 12.3 mt -65.91 -44.41 85.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -39.5 89.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -67.17 -51.8 49.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.909 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -66.46 -62.17 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.078 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.52 28.42 7.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.502 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 10.4 pt -100.8 166.71 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 75.1 m -79.39 159.35 27.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.477 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.09 -31.49 70.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -63.26 -38.93 93.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.148 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.506 ' O ' HG22 ' A' ' 396' ' ' VAL . 27.5 t -75.7 -34.51 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 33.1 t80 -73.67 -43.17 60.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.946 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.85 -32.32 72.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -68.56 -55.4 11.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.0 m -64.42 -35.87 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.117 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -71.98 -69.15 0.41 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.205 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.415 ' N ' ' CD1' ' A' ' 398' ' ' PHE . 4.7 p90 -139.68 110.68 6.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.969 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.6 93.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.66 -165.47 2.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.801 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.86 131.09 43.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -59.01 -32.23 69.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.082 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.65 -20.6 77.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.703 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.512 ' HG ' HD11 ' A' ' 408' ' ' ILE . 24.0 tp -64.77 -48.02 76.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.915 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.8 tt -57.88 -36.65 72.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.065 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.8 p -67.15 -29.89 69.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -80.1 -35.83 36.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.956 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.915 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -66.29 -37.1 78.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.058 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.13 -32.52 33.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -71.07 -49.58 43.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -73.57 -33.7 64.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.93 31.09 20.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 413' ' ' GLU . . . . . 0.417 ' OE2' HG23 ' A' ' 417' ' ' THR . 9.1 tp10 -64.19 98.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.02 155.45 54.58 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.869 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.567 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 34.3 Cg_endo -64.31 -19.25 65.46 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.656 2.237 . . . . 0.0 112.464 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -58.26 -29.53 65.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.02 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 417' ' ' THR . . . . . 0.417 HG23 ' OE2' ' A' ' 413' ' ' GLU . 9.0 t -133.91 19.15 3.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.489 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.567 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -93.68 146.43 23.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.48 179.04 0.65 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.907 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.569 ' O ' HG23 ' A' ' 424' ' ' VAL . 7.4 mm-40 -66.7 -39.32 88.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.051 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -45.14 93.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.746 ' O ' HD13 ' A' ' 422' ' ' LEU . 3.3 tm? -62.13 -33.02 73.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.802 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.53 -32.55 72.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -67.43 -51.1 55.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.142 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -63.44 -36.49 83.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.004 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.12 -38.81 79.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -63.32 -39.86 95.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.3 -38.72 92.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.112 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 3.1 ttm -67.97 -33.66 75.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.855 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -70.25 -39.92 74.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.81 -50.38 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.945 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.65 ' HE1' HD13 ' A' ' 443' ' ' ILE . 68.9 t80 -55.53 -41.39 73.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 378' ' ' TRP . 2.2 mt -68.66 -28.78 67.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -82.48 -22.24 35.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.16 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 34.3 mt -53.93 148.79 19.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.096 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 152.13 16.2 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.578 2.185 . . . . 0.0 112.38 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.53 -36.21 81.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.856 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.06 85.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 439' ' ' GLU . . . . . 0.447 ' O ' HD12 ' A' ' 443' ' ' ILE . 0.5 OUTLIER -73.34 -40.08 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.928 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.407 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 50.6 mtm-85 -59.45 -46.56 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -43.47 96.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.908 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -50.56 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.978 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.65 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.1 mt -60.62 -30.65 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 16.4 m-85 -75.79 -40.79 54.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -75.34 -42.14 55.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -59.58 93.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -153.16 -49.95 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.953 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' ARG . . . . . 0.511 ' CD ' HD11 ' A' ' 452' ' ' LEU . 0.4 OUTLIER -69.53 122.19 18.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.804 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -77.95 -177.69 5.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -71.44 -65.57 0.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 121.76 15.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.511 HD11 ' CD ' ' A' ' 448' ' ' ARG . 1.1 mp -104.62 -54.39 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -126.25 86.35 2.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.919 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -66.63 112.8 4.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.099 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.067 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.88 0.371 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.46 143.74 49.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.077 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -87.81 130.24 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.896 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.99 123.07 49.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.1 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.557 ' O ' HG22 ' A' ' 375' ' ' ILE . 69.3 m -90.57 166.38 13.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.912 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 6.2 m -59.38 -21.74 60.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.414 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.2 mt-10 -53.4 -27.78 26.01 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.189 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.8 tp -58.72 -45.02 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.105 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.484 ' N ' HG23 ' A' ' 375' ' ' ILE . 69.9 m-85 -66.23 -38.95 89.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.799 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -31.03 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.817 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.678 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.0 m0 -68.44 -42.14 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.04 -51.05 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.19 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -60.53 -48.94 79.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.57 -35.88 82.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -64.86 -47.03 79.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 69.5 mt -60.91 -44.55 96.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -60.22 -31.58 70.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.003 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -85.41 -38.49 18.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.8 -55.62 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.056 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.09 52.16 3.53 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 22.7 pt -131.24 179.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.824 0.345 . . . . 0.0 111.153 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -89.88 154.49 19.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -31.09 69.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.23 94.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.158 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.659 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.1 t -71.89 -31.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.185 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -75.28 -43.96 48.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.003 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.98 78.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.112 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.91 -59.5 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.874 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.6 m -59.87 -39.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.013 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 397' ' ' ALA . . . . . 0.438 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -66.13 -72.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.075 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.8 p90 -130.4 97.31 4.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.834 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -60.14 109.73 1.04 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.971 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 400' ' ' ARG . . . . . 0.716 ' O ' HG23 ' A' ' 401' ' ' THR . 0.6 OUTLIER -154.24 -70.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 401' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.8 OUTLIER -169.4 170.65 8.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -97.12 131.56 43.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.8 -27.95 6.62 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.545 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.55 -45.8 85.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.797 ' CD2' HD12 ' A' ' 409' ' ' LEU . 7.2 tt -58.54 -41.74 86.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.014 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.5 m -64.41 -30.06 71.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -29.22 42.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.02 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.741 HG23 HD21 ' A' ' 422' ' ' LEU . 7.3 mt -80.37 -39.7 19.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.797 HD12 ' CD2' ' A' ' 405' ' ' LEU . 11.7 mt -76.99 -50.67 12.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.139 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -33.36 71.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.026 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -36.66 81.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 60.64 34.75 20.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -91.29 126.14 36.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -71.42 148.99 93.68 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.954 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.78 -8.39 22.99 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.579 2.186 . . . . 0.0 112.642 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -56.94 -39.42 74.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.793 0.33 . . . . 0.0 111.019 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 80.8 p -125.56 32.49 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.139 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.84 147.77 24.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.106 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 83.1 p -65.66 -178.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 424' ' ' VAL . 3.1 tt0 -72.74 -40.69 65.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 14.4 t -60.37 -43.02 96.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.741 HD21 HG23 ' A' ' 408' ' ' ILE . 3.3 tm? -63.86 -40.98 97.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.18 -30.76 68.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -70.01 -40.2 78.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.037 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -63.25 -37.11 85.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.854 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.726 HD11 ' CD1' ' A' ' 422' ' ' LEU . 13.9 mt -75.57 -32.04 60.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -54.1 43.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.896 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.5 86.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 429' ' ' MET . . . . . 0.438 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 7.5 mtm -68.17 -35.5 78.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.851 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -65.75 -41.14 92.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.874 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -60.6 -40.3 91.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.598 ' HA ' HD12 ' A' ' 435' ' ' LEU . 34.8 t80 -64.18 -32.71 74.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.945 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 378' ' ' TRP . 37.4 mt -80.76 -28.75 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -70.0 -29.53 66.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.982 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.598 HD12 ' HA ' ' A' ' 432' ' ' PHE . 3.7 mt -58.75 151.54 52.68 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 156.76 6.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.546 2.164 . . . . 0.0 112.317 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -66.05 -37.75 86.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.943 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.89 71.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.077 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.92 -38.25 64.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.925 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 36.9 mtm-85 -59.59 -47.23 86.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.816 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.41 -37.46 85.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.84 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -37.14 86.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.428 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.5 mt -79.16 -40.83 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.014 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.405 ' HH ' ' HE2' ' A' ' 432' ' ' PHE . 15.8 m-85 -60.84 -43.17 98.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.841 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -29.66 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.913 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.16 -174.32 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.13 -165.96 2.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -96.52 137.04 36.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -60.85 -34.86 75.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.068 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.01 38.59 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.982 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.35 -39.84 18.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.4 mt -72.99 170.42 14.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.023 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.53 156.48 18.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -63.92 176.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.023 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.052 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.883 0.373 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 13.1 p -90.97 140.58 29.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.157 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -102.87 178.61 4.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.8 137.9 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.598 ' O ' HG22 ' A' ' 375' ' ' ILE . 3.1 m -97.98 178.77 5.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.98 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.7 t -69.01 -21.14 64.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.118 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.74 -27.95 20.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.089 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.747 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.2 tp -58.38 -40.28 77.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.595 ' OH ' HD21 ' A' ' 426' ' ' LEU . 97.2 m-85 -74.79 -37.26 62.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.83 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -31.37 70.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.704 ' CB ' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -70.7 -42.05 71.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 375' ' ' ILE . 28.0 t -61.8 -48.29 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -49.6 65.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.901 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.75 -45.4 92.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.09 -41.12 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.51 HD23 HG13 ' A' ' 388' ' ' ILE . 5.8 mt -60.21 -31.51 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.962 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.37 -49.75 12.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 3.1 mtt-85 -62.66 -36.78 83.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -79.49 -30.53 42.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 65.5 66.96 2.2 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.482 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.51 HG13 HD23 ' A' ' 383' ' ' LEU . 16.4 pt -143.78 173.43 5.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.809 0.337 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.3 m -91.75 154.04 19.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.945 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.444 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.3 mt-30 -60.12 -30.24 69.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.896 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.31 -41.43 89.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.156 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.6 t -75.57 -51.95 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.38 -29.28 63.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -71.02 -46.36 62.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.2 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.04 -48.69 80.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.9 m -67.42 -27.99 40.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.208 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -85.06 -76.11 0.33 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.21 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.437 ' CE1' HD12 ' A' ' 405' ' ' LEU . 16.3 p90 -125.53 118.48 25.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -74.29 107.71 6.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.841 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 400' ' ' ARG . . . . . 0.645 ' HG3' HG22 ' A' ' 401' ' ' THR . 22.6 tpp180 -154.17 -70.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 401' ' ' THR . . . . . 0.645 HG22 ' HG3' ' A' ' 400' ' ' ARG . 1.8 t -169.99 139.18 1.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -72.73 73.4 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.926 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -179.31 -37.51 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.9 tp -61.55 -29.07 69.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.444 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.8 tt -57.49 -37.1 72.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.968 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 89.1 p -72.71 -40.33 66.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.866 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.23 -42.13 99.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.821 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 422' ' ' LEU . 10.6 mt -67.88 -35.09 70.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 28.6 mt -76.21 -34.36 59.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -68.86 -41.7 78.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -60.44 -33.46 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 44.01 31.84 0.56 Allowed 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.406 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 135.34 33.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -67.2 144.7 98.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.489 ' HB3' HD22 ' A' ' 426' ' ' LEU . 85.7 Cg_endo -78.57 -0.66 10.92 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.538 2.159 . . . . 0.0 112.704 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -65.56 -37.02 85.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.987 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.1 p -123.56 25.93 8.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.269 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.506 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.03 174.9 5.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.119 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 70.2 m -69.76 171.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.819 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.797 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.1 pt20 -74.42 -32.01 62.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 16.7 m -61.17 -41.14 96.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.64 HD11 HG23 ' A' ' 408' ' ' ILE . 52.3 tp -69.11 -41.26 77.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.94 -31.68 70.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 420' ' ' GLN . 25.7 t -71.35 -47.63 58.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -64.56 -35.59 81.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.864 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.595 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.5 mp -67.1 -41.36 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.894 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -39.32 86.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.02 -44.12 97.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.9 mtt -63.26 -33.26 75.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.944 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -67.48 -42.39 83.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.15 -47.2 86.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.79 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.647 ' HE1' HD13 ' A' ' 443' ' ' ILE . 32.5 t80 -62.25 -31.15 71.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 378' ' ' TRP . 18.0 mt -84.59 -23.19 29.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.116 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -31.22 68.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.925 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.682 HD22 ' OE1' ' A' ' 439' ' ' GLU . 12.0 mt -64.98 154.88 85.46 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.74 156.14 59.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.482 2.121 . . . . 0.0 112.237 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -58.68 -30.96 67.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.942 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.37 94.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 439' ' ' GLU . . . . . 0.682 ' OE1' HD22 ' A' ' 435' ' ' LEU . 16.7 mt-10 -73.72 -37.15 65.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.895 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -59.79 -47.44 85.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.11 -41.35 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.647 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.2 mt -70.53 -32.95 51.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.134 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.427 ' CD1' HD13 ' A' ' 388' ' ' ILE . 14.2 m-85 -68.15 -39.64 82.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -75.36 -44.97 42.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.43 115.86 3.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.938 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -162.06 143.9 11.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -83.23 115.41 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.894 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.27 -26.77 63.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 51.28 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.991 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.02 37.05 1.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' A' ' 452' ' ' LEU . 3.4 mm? -67.7 143.38 55.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.953 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -131.72 -59.08 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -79.99 92.65 5.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.207 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.131 -179.951 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.819 0.342 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 369' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 370' ' ' GLU . 1.3 m -111.9 166.46 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 370' ' ' GLU . . . . . 0.466 ' H ' HG22 ' A' ' 369' ' ' THR . 51.0 mm-40 -60.46 156.46 16.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.964 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -98.7 109.61 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.158 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.656 ' O ' HG22 ' A' ' 375' ' ' ILE . 10.7 m -85.25 -177.07 6.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.785 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -25.88 61.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.8 mm-40 -54.79 -25.21 26.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.661 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.1 tp -56.99 -42.95 80.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.131 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.607 ' OH ' HD21 ' A' ' 426' ' ' LEU . 84.2 m-85 -72.63 -42.36 64.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.82 -31.31 72.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.826 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.442 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 35.6 m0 -67.46 -40.01 85.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -57.9 -59.44 3.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.11 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 45.1 mtt-85 -54.16 -34.91 61.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.99 -30.31 58.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 382' ' ' GLU . . . . . 0.457 ' OE1' HD21 ' A' ' 433' ' ' LEU . 4.6 tt0 -78.35 -36.17 46.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 393' ' ' PHE . 4.1 mm? -67.54 -44.39 78.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 52.2 tttt -69.76 -45.97 66.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.892 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.61 -54.84 41.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.94 -30.83 69.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.132 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 71.84 40.21 58.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.449 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 29.0 pt -125.37 176.86 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.162 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 95.1 p -91.61 155.42 18.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.989 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -59.19 -27.98 66.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.24 82.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.691 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.6 t -72.53 -31.32 37.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.425 ' CD2' HD21 ' A' ' 383' ' ' LEU . 71.6 t80 -73.39 -48.02 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.43 -36.99 76.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -67.35 -62.4 1.44 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.7 m -59.52 -29.45 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.168 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -75.26 -58.77 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.993 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.498 ' HE2' HD23 ' A' ' 404' ' ' LEU . 2.4 p90 -148.27 119.21 7.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.33 99.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -169.39 -168.07 0.77 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.736 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.47 149.36 33.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.053 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.91 -31.6 71.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -66.92 -25.86 73.19 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.553 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.498 HD23 ' HE2' ' A' ' 398' ' ' PHE . 6.7 tp -62.31 -50.36 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 0.0 111.005 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.433 HD21 HD12 ' A' ' 409' ' ' LEU . 7.1 tt -58.51 -38.35 77.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.052 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.3 p -68.6 -30.82 69.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.74 -31.41 52.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.996 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.72 HG23 HD11 ' A' ' 422' ' ' LEU . 9.9 mt -80.35 -30.81 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.987 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.433 HD12 HD21 ' A' ' 405' ' ' LEU . 5.0 mt -79.01 -34.62 43.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.832 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -67.79 -36.9 81.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 19.3 mmtm -60.12 -53.4 58.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 60.28 30.85 20.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -99.86 146.55 26.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.41 139.8 87.08 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.787 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -83.06 50.52 3.37 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.732 2.288 . . . . 0.0 112.606 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -100.05 -40.71 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.891 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.2 p -124.36 30.68 5.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.043 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.8 -169.62 2.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.116 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 57.8 m -90.17 172.27 8.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.777 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.9 OUTLIER -69.04 -31.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 92.3 p -59.62 -43.58 93.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.848 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.72 HD11 HG23 ' A' ' 408' ' ' ILE . 13.1 tp -68.21 -34.86 77.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.64 -39.56 84.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.777 HG23 ' O ' ' A' ' 420' ' ' GLN . 26.8 t -66.85 -44.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -64.92 -52.63 55.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.607 HD21 ' OH ' ' A' ' 376' ' ' TYR . 8.1 mp -59.93 -31.26 69.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -44.27 70.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.48 -45.8 82.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.1 mtp -59.85 -34.24 72.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -68.77 -32.4 72.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.49 -34.34 75.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.819 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -69.44 -35.58 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.457 HD21 ' OE1' ' A' ' 382' ' ' GLU . 2.5 mt -79.58 -30.77 41.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -72.79 -27.92 62.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.009 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.32 147.49 57.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.014 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.98 155.92 10.49 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.593 2.195 . . . . 0.0 112.249 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -66.23 -31.75 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.18 77.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.074 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -76.1 -40.17 53.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.864 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.494 ' HA ' HD12 ' A' ' 443' ' ' ILE . 62.2 mtm180 -70.86 -25.62 62.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.106 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.01 -49.5 50.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.062 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -41.91 99.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.094 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.494 HD12 ' HA ' ' A' ' 440' ' ' ARG . 15.8 mt -61.68 -50.17 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.994 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.403 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 12.5 m-85 -61.32 -30.97 70.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.938 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -79.5 -60.76 2.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.839 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.72 108.79 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.86 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.27 -49.82 2.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.883 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 130.57 38.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.946 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.91 -165.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -57.12 -46.79 82.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 86.5 p -75.4 -174.33 2.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.841 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.41 36.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -101.2 103.64 14.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.953 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -72.57 144.52 47.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.118 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.091 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.1 m120 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.816 0.341 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 59.75 160.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.113 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -129.92 153.42 48.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 29.0 t -70.12 102.57 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.984 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -70.12 169.22 13.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -16.71 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.217 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.433 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.1 mp0 -51.36 -28.15 11.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.762 0.315 . . . . 0.0 111.183 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.619 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.0 tp -58.51 -37.78 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.0 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.603 ' HE1' HG22 ' A' ' 408' ' ' ILE . 36.8 m-85 -73.51 -42.95 61.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.78 -32.17 73.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.99 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.433 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.9 m0 -66.28 -41.9 89.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.921 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 375' ' ' ILE . 32.5 t -61.15 -35.35 65.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.007 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.19 -31.39 65.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -73.8 -37.92 64.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 382' ' ' GLU . . . . . 0.563 ' OE2' ' HB2' ' A' ' 386' ' ' ALA . 1.2 tm-20 -76.2 -37.84 57.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.944 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.34 -31.2 71.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.907 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -86.65 -31.26 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.79 -67.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 386' ' ' ALA . . . . . 0.563 ' HB2' ' OE2' ' A' ' 382' ' ' GLU . . . -59.29 -41.94 90.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 74.18 70.88 1.18 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.488 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.409 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 21.1 pt -134.11 158.0 42.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.055 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.17 160.9 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.802 ' HG2' HD23 ' A' ' 405' ' ' LEU . 2.6 mt-30 -66.19 -31.43 72.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.854 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.59 69.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.212 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.826 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.5 t -84.01 -59.54 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.275 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -58.02 -26.84 62.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -81.05 -40.51 24.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.27 -39.64 59.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.169 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.826 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.4 m -71.61 -32.05 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.224 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -81.22 -66.51 0.88 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.456 ' CE1' ' HE2' ' A' ' 429' ' ' MET . 16.5 p90 -128.36 114.85 17.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -59.59 109.08 0.82 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -169.57 -172.38 1.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -69.84 132.13 45.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.139 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -63.93 154.61 33.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 95.01 -24.5 28.33 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -58.97 -41.11 86.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.791 0.329 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.802 HD23 ' HG2' ' A' ' 390' ' ' GLN . 2.2 tp -57.38 -33.77 68.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 8.0 t -65.41 -43.74 89.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.932 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -69.08 -41.92 76.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.008 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.603 HG22 ' HE1' ' A' ' 376' ' ' TYR . 25.7 mt -62.58 -40.49 88.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.013 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.463 HD23 ' HD1' ' A' ' 376' ' ' TYR . 58.7 mt -72.18 -37.01 69.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.021 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -44.02 73.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mmmt -58.82 -39.53 81.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.013 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 59.62 30.73 20.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -93.52 109.13 20.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.29 167.6 6.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.409 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 55.3 Cg_endo -69.8 -9.97 27.38 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.505 2.137 . . . . 0.0 112.657 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -30.04 46.23 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.02 32.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.144 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -92.74 177.0 6.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.043 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 5.3 m -89.3 173.42 8.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.0 OUTLIER -61.32 -41.73 97.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.934 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 57.9 m -60.82 -41.71 96.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.873 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.547 HD13 ' C ' ' A' ' 422' ' ' LEU . 3.5 tm? -60.43 -42.47 96.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.847 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 25.7 mt -59.86 -42.24 93.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 420' ' ' GLN . 28.0 t -62.37 -30.45 49.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.097 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 425' ' ' ASN . . . . . 0.401 ' OD1' ' CE2' ' A' ' 398' ' ' PHE . 1.9 m-80 -70.95 -44.88 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.535 HD11 HD11 ' A' ' 422' ' ' LEU . 28.7 mt -67.39 -44.25 79.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.894 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 11.3 mtt180 -59.88 -40.17 87.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -71.57 -34.62 70.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 429' ' ' MET . . . . . 0.456 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 7.3 mtt -73.35 -33.84 65.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -66.15 -46.71 76.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -64.75 -38.37 90.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.738 ' HA ' HD12 ' A' ' 435' ' ' LEU . 56.8 t80 -71.17 -34.45 70.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.0 mt -75.53 -30.68 59.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -72.65 -27.4 62.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.738 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.8 mt -56.64 157.44 10.1 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.86 147.35 32.74 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.618 2.212 . . . . 0.0 112.331 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -63.98 -42.29 97.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.959 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.08 -31.66 70.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.65 -42.46 58.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -60.12 -45.19 93.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -62.23 -38.63 89.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.804 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -37.99 82.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.483 HD13 ' HE1' ' A' ' 432' ' ' PHE . 19.8 mt -73.65 -35.85 45.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.036 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.452 ' HE1' HG21 ' A' ' 396' ' ' VAL . 22.2 m-85 -67.14 -41.07 86.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -84.52 -16.92 40.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.283 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.76 -66.93 0.3 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 61.96 116.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -98.97 134.56 41.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.04 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.35 174.11 0.77 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.816 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.4 60.15 1.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.837 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 19.9 m -91.19 115.47 28.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.855 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.51 170.95 8.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -113.73 171.1 7.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.915 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -69.16 110.28 4.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.071 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.134 -179.96 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.887 0.375 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.7 p -130.26 106.17 8.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.99 40.21 3.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.949 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 371' ' ' VAL . . . . . 0.43 HG11 HD13 ' A' ' 426' ' ' LEU . 21.5 t -124.22 111.36 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.163 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.65 ' O ' HG22 ' A' ' 375' ' ' ILE . 39.7 m -100.02 173.65 6.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 21.5 t -58.63 -25.42 62.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -55.6 -24.74 34.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.138 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -57.46 -42.54 81.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.116 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.448 ' N ' HG23 ' A' ' 375' ' ' ILE . 87.6 m-85 -72.97 -47.48 45.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.905 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.95 -28.57 66.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.042 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 41.5 m0 -68.17 -56.27 9.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.924 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.421 HG22 HD11 ' A' ' 433' ' ' LEU . 22.3 t -58.65 -47.21 89.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -58.37 -38.72 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.66 -41.45 31.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.51 -40.2 95.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.894 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.24 -56.71 17.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.49 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -69.51 -33.01 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -86.51 -30.68 21.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 70.49 28.43 71.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.57 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 36.3 pt -106.87 164.32 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 151.86 36.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.984 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -60.78 -31.04 70.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.01 -40.21 94.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.8 t -73.65 -32.05 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.089 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -75.87 -51.26 12.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -59.62 -31.15 69.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.146 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -70.13 -43.09 71.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.932 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.01 -32.4 12.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.19 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.18 -65.8 0.76 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.193 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -135.78 106.63 6.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -70.28 95.14 0.98 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.87 -71.37 0.46 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.12 131.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.152 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.48 125.95 25.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.93 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.54 -27.69 6.8 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.507 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.506 HD23 HD11 ' A' ' 408' ' ' ILE . 5.3 tp -63.16 -33.17 74.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.861 0.362 . . . . 0.0 111.036 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 394' ' ' ALA . 3.4 tt -58.57 -43.3 89.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 59.8 p -67.3 -29.66 69.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.21 -44.25 38.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.506 HD11 HD23 ' A' ' 404' ' ' LEU . 12.7 mt -67.92 -33.55 61.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.156 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.5 mm? -76.95 -30.51 56.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.944 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 -67.62 -37.15 82.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -68.47 -50.9 48.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.96 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 61.24 31.58 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -95.68 129.92 42.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.834 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.89 165.6 9.62 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.622 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 57.2 Cg_endo -70.65 -8.97 24.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.614 2.209 . . . . 0.0 112.613 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -56.34 -40.66 74.82 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 t -110.74 -21.6 12.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.369 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -58.25 148.06 28.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.912 0.387 . . . . 0.0 111.109 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 33.9 m -76.89 -178.06 4.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.935 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.831 ' O ' HG23 ' A' ' 424' ' ' VAL . 9.2 tm0? -63.72 -30.45 71.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.923 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.9 m -57.4 -50.95 71.36 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.029 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 426' ' ' LEU . 0.7 OUTLIER -64.29 -40.19 95.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.689 ' HA ' HD12 ' A' ' 426' ' ' LEU . 96.3 mt -58.34 -31.99 68.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.0 t -74.07 -32.37 32.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.976 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -74.78 -40.96 60.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 423' ' ' LEU . 2.8 mt -65.68 -40.76 92.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -59.99 -41.17 91.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.814 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.91 94.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -38.83 73.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -60.9 -45.17 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.72 -39.58 80.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.878 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.58 ' HE1' HD13 ' A' ' 443' ' ' ILE . 86.5 t80 -70.41 -35.73 73.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.421 HD11 HG22 ' A' ' 379' ' ' VAL . 6.5 mt -81.3 -30.93 33.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -70.03 -29.13 66.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.903 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 17.7 mt -58.19 152.53 40.99 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.917 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.03 148.47 23.61 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.524 2.149 . . . . 0.0 112.32 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -60.97 -32.85 72.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.03 -38.08 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.047 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 439' ' ' GLU . . . . . 0.522 ' OE1' HD22 ' A' ' 435' ' ' LEU . 15.9 mt-10 -69.95 -40.2 75.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -60.15 -40.45 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -63.73 -37.23 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.01 -41.29 77.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.58 HD13 ' HE1' ' A' ' 432' ' ' PHE . 13.5 mt -69.43 -38.46 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.081 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -67.06 -33.57 75.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.936 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.47 -19.27 23.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.88 115.03 1.63 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.149 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -116.0 -50.75 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.839 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -79.03 127.26 31.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.81 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -86.99 6.39 32.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.455 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -82.52 -17.52 44.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.68 0.276 . . . . 0.0 111.163 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 74.0 m -54.43 -71.43 0.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 111.049 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 5.2 tp -160.86 90.17 0.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -164.65 121.97 1.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -64.82 145.87 55.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.117 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.078 179.954 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 368' ' ' ASN . . . . . 0.615 ' N ' HD21 ' A' ' 368' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.835 0.35 . . . . 0.0 111.081 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.0 t -142.86 121.73 12.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.155 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.66 149.21 22.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.78 143.0 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.549 ' O ' HG22 ' A' ' 375' ' ' ILE . 2.9 m -100.16 168.11 10.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -22.86 64.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 84.2 mt-10 -53.74 -26.61 24.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.211 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.695 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.2 tp -57.27 -44.84 84.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.196 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.492 ' N ' HG23 ' A' ' 375' ' ' ILE . 88.4 m-85 -73.22 -34.24 65.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -30.31 65.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.591 ' CB ' HD13 ' A' ' 433' ' ' LEU . 40.7 m0 -71.41 -37.8 71.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.979 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -64.72 -39.78 86.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.198 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 19.5 mtt-85 -67.97 -55.68 11.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -59.45 -30.66 68.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -78.83 -30.77 45.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.013 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 8.7 mt -68.5 -58.36 4.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -41.19 88.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.908 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -64.65 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.95 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.34 -52.32 65.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.067 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.36 69.29 1.36 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.413 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.493 HD13 ' CE1' ' A' ' 444' ' ' TYR . 33.9 pt -138.02 176.14 7.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 111.124 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 m -90.57 153.84 20.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.02 -30.94 69.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.88 90.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.093 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 396' ' ' VAL . 29.8 t -74.66 -35.32 37.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.176 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.629 ' CZ ' HG13 ' A' ' 379' ' ' VAL . 42.9 t80 -72.06 -25.97 61.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.091 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.42 -55.5 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.348 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -58.38 -46.93 85.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.059 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.687 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.3 m -63.22 -33.07 58.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -84.74 -70.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.454 ' CE2' ' HG2' ' A' ' 400' ' ' ARG . 2.0 p90 -143.05 112.85 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.94 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -58.62 124.77 20.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 400' ' ' ARG . . . . . 0.454 ' HG2' ' CE2' ' A' ' 398' ' ' PHE . 0.0 OUTLIER -170.1 -172.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.91 113.94 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.109 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.29 131.4 10.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.374 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.36 -14.36 10.93 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.784 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.0 tp -79.76 -43.03 23.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.746 0.307 . . . . 0.0 111.04 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.703 HD23 ' O ' ' A' ' 405' ' ' LEU . 9.2 tt -55.39 -28.38 53.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.21 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 24.9 p -70.95 -50.3 36.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.066 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.29 -41.38 94.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.592 HG23 HD11 ' A' ' 422' ' ' LEU . 28.4 mt -59.88 -44.62 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.019 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.552 HD12 ' CD2' ' A' ' 405' ' ' LEU . 7.4 mt -75.52 -30.61 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -47.6 65.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.895 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -66.89 -41.63 86.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 61.24 31.61 19.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.2 137.85 53.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -75.44 149.6 84.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.833 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.69 -5.74 17.56 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.552 2.168 . . . . 0.0 112.683 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -66.27 -57.59 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.774 0.321 . . . . 0.0 111.064 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 76.4 p -108.67 34.32 3.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.215 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 -177.26 3.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.3 174.61 8.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.979 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.655 ' O ' HG23 ' A' ' 424' ' ' VAL . 2.1 mt-30 -71.66 -31.73 67.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.592 HD11 HG23 ' A' ' 408' ' ' ILE . 5.0 tp -63.11 -39.23 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 420' ' ' GLN . 87.0 mt -59.94 -33.99 72.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 420' ' ' GLN . 29.1 t -73.91 -38.14 49.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.071 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -69.28 -50.14 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.938 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.553 HD22 HG21 ' A' ' 375' ' ' ILE . 75.0 mt -57.63 -32.01 66.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.981 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -63.8 -45.56 89.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.25 -43.28 74.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.137 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -35.33 75.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -69.74 -44.27 70.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -64.4 -35.3 80.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.933 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.77 -33.19 72.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 378' ' ' TRP . 11.7 mt -84.66 -30.46 24.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.876 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -70.85 -29.06 65.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.915 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.509 HD22 ' OE2' ' A' ' 439' ' ' GLU . 28.9 mt -57.79 158.72 11.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.31 165.47 30.35 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.639 2.226 . . . . 0.0 112.296 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.21 -33.14 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -34.95 74.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 439' ' ' GLU . . . . . 0.509 ' OE2' HD22 ' A' ' 435' ' ' LEU . 0.5 OUTLIER -74.74 -52.14 12.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.636 ' HA ' HD12 ' A' ' 443' ' ' ILE . 46.9 mtm180 -59.46 -30.54 68.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.996 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.71 -34.74 69.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.996 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -77.1 -31.55 56.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.636 HD12 ' HA ' ' A' ' 440' ' ' ARG . 7.0 mt -75.71 -40.51 40.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.053 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.493 ' CE1' HD13 ' A' ' 388' ' ' ILE . 13.0 m-85 -68.04 -29.48 68.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -84.71 -54.64 4.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.07 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.61 -178.03 6.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.045 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -162.52 -171.68 2.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.827 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.12 -56.41 2.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.895 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.82 -170.68 1.68 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.889 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -74.51 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.879 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.0 m -83.14 -175.91 6.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.858 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.6 171.17 7.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -134.01 23.86 3.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -100.09 76.39 1.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.098 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.199 179.899 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 9.0 p30 . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.764 0.316 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 13.1 p -64.83 -58.33 6.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.164 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -101.41 170.76 8.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.3 89.07 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.138 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.491 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -64.82 158.27 25.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.017 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.4 m -63.05 -21.41 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.11 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.6 mt-10 -53.03 -26.5 15.87 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.13 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.85 ' O ' HG23 ' A' ' 379' ' ' VAL . 6.5 tp -57.85 -42.62 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 111.132 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.584 ' CZ ' HD21 ' A' ' 426' ' ' LEU . 99.2 m-85 -70.47 -44.29 68.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -65.63 -31.34 72.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.947 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 45.6 m0 -70.57 -34.79 72.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.8 t -64.74 -37.73 80.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.031 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.8 -38.64 64.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.935 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -73.63 -34.67 65.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.949 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.9 -47.74 50.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.561 HD21 ' CB ' ' A' ' 393' ' ' PHE . 21.9 mt -59.87 -30.88 69.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -81.68 -39.16 24.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -72.81 -32.27 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -76.5 -67.72 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 106.54 58.68 0.6 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.467 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 31.8 pt -141.53 -179.71 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 0.0 111.072 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.41 154.81 17.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.786 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.839 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -58.78 -29.72 67.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.002 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.76 -47.35 86.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.161 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -51.64 49.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.15 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.561 ' CB ' HD21 ' A' ' 383' ' ' LEU . 51.6 t80 -58.41 -45.45 88.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.411 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -63.07 -30.08 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.185 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -51.38 12.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.943 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.51 -36.78 77.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.201 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -68.73 -58.34 4.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.425 ' CE1' HD12 ' A' ' 405' ' ' LEU . 20.3 p90 -150.81 111.05 4.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.097 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -75.22 119.65 19.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.59 -65.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.848 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 401' ' ' THR . . . . . 0.762 HG23 ' HB2' ' A' ' 404' ' ' LEU . 2.6 t -161.46 146.7 13.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -80.08 147.85 31.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 77.1 3.79 82.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.79 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.762 ' HB2' HG23 ' A' ' 401' ' ' THR . 12.5 tp -88.31 -29.57 20.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.87 0.366 . . . . 0.0 110.93 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.0 tt -63.66 -20.9 66.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.164 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 85.3 p -68.42 -64.93 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.202 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -53.43 -40.07 64.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.242 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 422' ' ' LEU . 41.6 mt -59.88 -33.2 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.338 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.2 mt -91.23 -30.52 16.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.876 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 15.7 ttp85 -72.67 -40.21 66.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.22 -41.31 92.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.874 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 61.09 31.75 19.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.99 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -78.72 142.61 36.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -85.36 142.58 37.97 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.5 ' HB3' HD23 ' A' ' 423' ' ' LEU . 52.6 Cg_exo -52.4 -25.66 25.41 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.528 2.152 . . . . 0.0 112.43 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -57.43 -47.25 82.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.01 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.7 p -110.42 28.75 8.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.205 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.424 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.13 -178.71 3.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.125 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 74.7 m -99.94 172.48 7.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.778 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.9 mt-30 -62.25 -34.0 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.941 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.27 -46.03 85.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.734 HD11 HG23 ' A' ' 408' ' ' ILE . 7.3 tp -65.36 -40.67 93.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.909 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 420' ' ' GLN . 31.2 mt -59.65 -35.91 75.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.817 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.5 t -78.12 -37.19 22.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.853 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -60.69 -48.48 81.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.79 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.584 HD21 ' CZ ' ' A' ' 376' ' ' TYR . 3.6 mt -65.12 -37.48 87.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.761 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.93 -41.95 97.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.96 92.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.018 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.0 mtm -60.67 -34.22 74.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.798 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -64.43 -45.76 86.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.743 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.36 -48.81 80.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.852 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.46 ' HE1' HD13 ' A' ' 443' ' ' ILE . 54.3 t80 -60.63 -31.35 70.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.832 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.34 -28.61 26.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.941 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -69.94 -34.88 74.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.21 146.89 82.54 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.64 152.4 16.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.47 2.113 . . . . 0.0 112.329 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -31.1 69.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.11 93.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.018 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.16 -40.79 74.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.85 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 28.7 mtm-85 -61.87 -38.94 90.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.828 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -66.87 -38.72 86.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -35.41 78.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.863 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.46 HD13 ' HE1' ' A' ' 432' ' ' PHE . 7.5 mt -81.68 -35.37 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.09 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.21 -34.7 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.939 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -62.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.941 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -64.12 121.07 13.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -111.46 168.0 9.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.908 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.91 14.63 20.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.301 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -76.57 -39.53 52.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 0.0 111.021 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -97.8 30.76 2.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.874 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.0 p -85.19 -43.52 13.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.2 30.67 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -92.27 -59.85 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -62.79 -31.09 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.103 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.097 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 368' ' ' ASN . . . . . 0.518 HD21 ' N ' ' A' ' 368' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.822 0.344 . . . . 0.0 111.264 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 369' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 369' ' ' THR . 2.1 t -99.22 98.36 9.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -88.41 129.65 35.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.51 124.23 70.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.077 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.599 ' O ' HG22 ' A' ' 375' ' ' ILE . 4.8 m -86.52 170.25 12.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.992 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -21.74 63.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.423 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 2.5 mp0 -52.15 -28.1 16.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.216 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.6 tp -58.81 -41.54 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.066 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.433 ' N ' HG23 ' A' ' 375' ' ' ILE . 92.0 m-85 -71.09 -36.44 72.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.827 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -69.31 -36.21 76.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.423 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.0 m0 -63.24 -40.48 97.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 375' ' ' ILE . 26.2 t -58.67 -52.58 58.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -60.08 -40.6 90.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.02 -36.51 80.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.02 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.17 -46.61 61.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.03 -35.22 74.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.88 -51.28 9.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.892 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -63.72 -52.24 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.931 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.5 8.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 94.64 59.06 1.15 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.476 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 33.7 pt -138.54 165.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.334 . . . . 0.0 111.089 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.75 157.95 31.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -30.69 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.929 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.93 -36.29 76.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.287 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.49 -52.53 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.141 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -57.02 -30.89 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.68 -29.36 29.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.104 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -73.6 -46.7 45.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.958 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.56 -38.1 75.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.17 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -69.15 -57.71 5.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -153.59 105.59 2.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.845 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -73.65 97.25 2.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 23.8 mtt85 -146.21 -65.35 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.831 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 401' ' ' THR . . . . . 0.545 HG22 ' H ' ' A' ' 403' ' ' GLY . 26.3 m -154.16 117.65 4.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.075 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -60.88 -23.08 64.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.209 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 403' ' ' GLY . . . . . 0.545 ' H ' HG22 ' A' ' 401' ' ' THR . . . -91.17 17.45 55.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.875 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.481 ' HG ' HD11 ' A' ' 408' ' ' ILE . 10.0 tp -100.02 -37.85 8.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.317 . . . . 0.0 110.908 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 1.6 tp -57.92 -42.77 85.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.977 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 3.3 t -64.78 -29.51 70.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.031 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -80.15 -43.15 22.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.481 HD11 ' HG ' ' A' ' 404' ' ' LEU . 10.6 mt -67.97 -42.73 85.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.052 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 25.5 mt -66.57 -33.6 76.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.67 -38.31 73.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -65.9 -49.88 66.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.18 31.05 20.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.919 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.63 135.58 38.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -70.49 127.73 91.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.861 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.73 54.06 5.06 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.511 2.14 . . . . 0.0 112.478 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -100.03 -43.57 6.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.805 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.0 p -128.46 31.32 5.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.094 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.34 -178.31 6.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.3 p -77.27 175.05 10.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.856 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.7 mp0 -76.63 -31.44 57.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.932 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 3.2 t -59.46 -39.8 84.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.23 -40.8 64.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.72 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.845 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.856 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.4 t -60.43 -46.98 94.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.991 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -63.82 -46.42 85.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.76 -33.68 75.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.836 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -41.42 99.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.15 -49.73 76.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.994 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 6.4 ttm -66.13 -37.64 86.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -45.82 88.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -61.84 -36.74 82.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.747 ' HE1' HD13 ' A' ' 443' ' ' ILE . 17.1 t80 -68.91 -39.36 79.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.798 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.493 HD11 HG22 ' A' ' 379' ' ' VAL . 5.9 mt -78.21 -32.38 49.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -71.04 -30.71 66.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 432' ' ' PHE . 9.8 mt -58.92 159.5 13.34 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.4 147.83 90.73 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.549 2.166 . . . . 0.0 112.293 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.17 -29.98 67.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.15 -42.71 86.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.094 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.16 -42.42 65.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.483 ' HA ' HD12 ' A' ' 443' ' ' ILE . 41.6 mtm-85 -59.1 -42.22 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.68 -42.37 96.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.873 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -62.44 -50.05 73.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.747 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.6 mt -60.01 -42.62 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -65.65 -31.92 73.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -85.55 -3.92 59.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.407 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -97.5 30.67 2.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.791 0.329 . . . . 0.0 111.094 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -83.99 126.27 32.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.907 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -64.41 81.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.99 -169.76 1.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.972 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.54 -24.59 53.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.088 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 10.8 t -55.26 121.29 8.55 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.09 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.731 HD23 ' N ' ' A' ' 453' ' ' ASN . 3.0 tt -138.05 130.24 28.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 453' ' ' ASN . . . . . 0.731 ' N ' HD23 ' A' ' 452' ' ' LEU . 0.5 OUTLIER -120.24 103.71 9.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.89 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -90.97 -64.06 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.126 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.114 -179.956 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 368' ' ' ASN . . . . . 0.759 ' N ' HD21 ' A' ' 368' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.852 0.358 . . . . 0.0 111.244 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.72 96.28 10.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.172 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.35 107.18 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 24.2 t -81.12 122.13 35.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.003 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 375' ' ' ILE . 13.0 m -99.62 169.38 9.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 79.6 p -63.5 -21.75 66.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.116 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 9.2 mm-40 -51.86 -27.16 11.76 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 111.211 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.712 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.1 tp -57.93 -44.88 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.167 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.592 ' OH ' HD21 ' A' ' 426' ' ' LEU . 93.1 m-85 -67.11 -43.6 82.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -67.61 -30.37 69.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.951 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 39.2 m0 -68.15 -42.05 80.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.948 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.3 t -59.53 -43.93 91.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.167 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -60.69 -57.19 13.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -46.36 89.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.29 -33.41 67.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.049 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.1 mt -71.14 -30.56 66.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.74 -35.0 24.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.53 -31.71 57.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.41 -44.95 15.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 73.92 63.98 2.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.447 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.497 HD11 ' HD2' ' A' ' 393' ' ' PHE . 41.4 pt -139.52 167.22 20.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.103 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 151.26 30.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.543 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.29 -31.77 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.828 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.47 -39.5 91.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.131 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 24.8 t -75.86 -42.35 39.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.099 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.497 ' HD2' HD11 ' A' ' 388' ' ' ILE . 24.3 t80 -60.43 -50.46 73.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.64 -31.56 72.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -62.38 1.71 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -62.93 -37.06 78.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 397' ' ' ALA . . . . . 0.481 ' O ' ' HB1' ' A' ' 428' ' ' ALA . . . -67.64 -63.78 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.127 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.458 ' HE2' HD23 ' A' ' 404' ' ' LEU . 9.6 p90 -152.03 109.48 3.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.13 94.37 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.793 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -141.92 -70.11 0.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.793 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -157.41 165.14 36.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.02 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.65 -25.16 22.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.069 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -84.48 -26.03 40.78 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.628 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 404' ' ' LEU . . . . . 0.474 ' HG ' HD11 ' A' ' 408' ' ' ILE . 26.3 tp -58.59 -45.39 89.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.543 HD22 ' CG ' ' A' ' 390' ' ' GLN . 6.2 tt -60.08 -38.29 82.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.947 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 21.4 p -69.82 -31.1 68.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.936 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.26 -40.36 64.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 376' ' ' TYR . 11.4 mt -72.09 -47.59 53.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.06 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.35 -35.79 81.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.3 -42.37 65.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -48.78 80.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 60.27 32.93 20.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.97 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -91.07 126.6 36.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.922 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.66 151.36 71.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.7 46.49 2.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.769 2.313 . . . . 0.0 112.638 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -100.18 -34.06 10.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.748 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.4 31.15 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.42 -174.85 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 419' ' ' SER . . . . . 0.483 ' O ' HD23 ' A' ' 423' ' ' LEU . 94.6 p -99.77 179.26 4.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.97 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.658 ' O ' HG23 ' A' ' 424' ' ' VAL . 49.9 tp60 -62.18 -52.27 64.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 2.7 t -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.936 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 422' ' ' LEU . 1.2 tm? -69.91 -33.9 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 419' ' ' SER . 4.2 mm? -77.69 -40.42 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.832 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -59.62 -48.98 85.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.142 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.54 -42.55 91.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.959 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.592 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.9 mp -65.05 -32.4 74.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.0 ttm105 -65.61 -40.72 92.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' A' ' 397' ' ' ALA . . . -59.82 -50.46 73.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.163 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 26.7 mtm -60.97 -34.27 74.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -70.53 -50.81 33.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.924 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.59 -35.1 75.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.529 ' HA ' HD12 ' A' ' 435' ' ' LEU . 42.0 t80 -74.33 -31.67 62.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 379' ' ' VAL . 21.3 mt -82.29 -31.32 30.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -79.23 -26.34 42.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 432' ' ' PHE . 8.9 mt -55.88 159.66 5.21 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.055 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -51.7 141.74 43.09 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.59 2.193 . . . . 0.0 112.435 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.75 -39.75 95.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.98 -32.38 73.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.49 -40.47 66.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.824 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 444' ' ' TYR . 87.5 mtm-85 -59.63 -41.05 89.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.47 -45.64 93.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -60.92 -41.8 96.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.45 -34.36 52.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.033 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 440' ' ' ARG . 10.9 m-85 -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.988 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -89.59 -52.76 4.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.78 101.53 0.27 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -118.48 -170.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.814 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -78.26 118.77 20.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.13 174.58 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -53.59 5.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.05 103.07 14.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.886 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.94 64.72 6.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.8 -73.62 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.88 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -64.05 126.4 27.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.076 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.894 0.378 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.9 m 59.06 31.09 21.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.238 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -128.95 121.22 27.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.87 112.38 5.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.429 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -84.18 175.06 9.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.6 t -58.6 -21.57 53.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.202 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.7 mt-10 -52.55 -26.19 12.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.208 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.0 tp -56.98 -44.36 82.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.133 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.485 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.2 m-85 -69.72 -43.73 71.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -65.45 -31.51 72.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.606 ' HB3' HD13 ' A' ' 433' ' ' LEU . 36.0 m0 -65.49 -45.05 85.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -61.8 -38.67 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.103 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -67.83 -49.15 63.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -31.56 72.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.992 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -77.38 -31.3 54.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.986 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.89 -33.0 67.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.57 -34.39 35.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.872 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -78.53 -32.12 47.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -83.61 -56.75 3.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.94 52.47 2.24 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 4.0 pt -137.65 162.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.32 . . . . 0.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 19.7 m -74.53 150.46 39.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.686 ' HB3' HD22 ' A' ' 405' ' ' LEU . 79.1 mt-30 -60.19 -28.9 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.927 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.94 -46.4 85.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.223 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 28.8 t -69.92 -41.67 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.433 ' CE1' HG13 ' A' ' 379' ' ' VAL . 52.1 t80 -59.96 -36.58 77.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.015 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.7 -40.9 88.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -62.98 -51.8 65.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.19 -31.11 50.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.119 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.35 -76.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.566 ' HB3' ' HB3' ' A' ' 428' ' ' ALA . 7.2 p90 -126.93 117.99 23.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.71 95.5 6.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.788 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -145.18 -65.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.91 156.98 43.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.031 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -90.3 -32.85 16.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.06 26.79 19.27 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.522 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -99.98 -46.42 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.96 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.781 ' HA ' HD12 ' A' ' 408' ' ' ILE . 3.9 tt -57.89 -34.8 70.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.019 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.36 -30.88 67.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -79.42 -38.87 33.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.994 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -63.68 -51.05 75.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 405' ' ' LEU . 4.3 mm? -59.9 -38.96 83.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -37.39 83.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -63.63 -47.73 80.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 60.53 32.01 20.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.952 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.39 149.91 20.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.32 148.59 93.71 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.981 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.553 ' HB3' HD13 ' A' ' 426' ' ' LEU . 69.4 Cg_endo -74.42 -5.74 17.34 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.198 . . . . 0.0 112.602 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.61 -30.99 68.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.087 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.3 t -127.02 21.07 6.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.39 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.98 171.0 15.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 419' ' ' SER . . . . . 0.415 ' O ' HD23 ' A' ' 423' ' ' LEU . 32.9 t -74.16 172.54 11.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.767 ' O ' HG23 ' A' ' 424' ' ' VAL . 16.2 pm0 -72.72 -30.42 64.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 52.1 p -67.94 -42.4 81.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.856 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 426' ' ' LEU . 1.1 tt -67.67 -40.75 84.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.507 ' HA ' HD12 ' A' ' 426' ' ' LEU . 2.7 mm? -57.77 -32.71 67.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.5 t -72.64 -35.4 50.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.984 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.77 -43.59 68.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.647 HD11 HD22 ' A' ' 422' ' ' LEU . 11.3 mt -60.07 -33.57 72.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -62.25 -56.29 20.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.566 ' HB3' ' HB3' ' A' ' 398' ' ' PHE . . . -62.86 -32.48 73.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.104 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 12.0 mtm -71.57 -36.57 70.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -66.74 -44.62 81.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.945 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -60.07 -46.01 90.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.609 ' HA ' HD12 ' A' ' 435' ' ' LEU . 20.8 t80 -58.14 -41.26 83.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.001 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.606 HD13 ' HB3' ' A' ' 378' ' ' TRP . 7.8 mt -71.49 -27.91 63.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.002 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -80.47 -25.03 39.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.166 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 432' ' ' PHE . 48.9 mt -55.36 154.14 12.28 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.014 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.34 145.59 35.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.568 2.179 . . . . 0.0 112.328 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -63.74 -35.04 79.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.66 -37.89 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -75.22 -42.0 56.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -59.27 -40.33 85.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.09 -42.74 96.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -47.56 80.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 31.3 mt -59.55 -34.43 54.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.949 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.02 -43.25 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.723 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -100.08 25.09 7.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.975 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.78 102.53 0.35 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -147.7 140.35 24.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.952 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 117.98 12.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -37.24 62.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.949 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -100.12 44.76 1.01 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.48 101.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.966 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -143.06 -48.7 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -72.99 120.47 18.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -68.01 -32.07 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.066 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.017 -179.941 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.818 0.342 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 369' ' ' THR . . . . . 0.416 HG22 HG23 ' A' ' 371' ' ' VAL . 3.1 m -91.36 96.38 10.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.127 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -95.57 86.6 4.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.872 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 371' ' ' VAL . . . . . 0.416 HG23 HG22 ' A' ' 369' ' ' THR . 25.2 t -92.66 80.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.102 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.765 ' O ' HG22 ' A' ' 375' ' ' ILE . 31.2 m -100.01 -174.38 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.4 t -58.15 -23.44 55.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.092 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 5.2 mm-40 -55.52 -28.66 56.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.083 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.801 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.1 tp -59.19 -32.58 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.92 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.562 ' HE2' HG22 ' A' ' 408' ' ' ILE . 82.0 m-85 -77.86 -42.86 32.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.94 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -32.73 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.944 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.1 m0 -69.03 -44.92 71.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.012 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 375' ' ' ILE . 37.0 t -61.42 -40.86 87.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.06 -30.77 61.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -45.75 48.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.962 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.36 -35.93 82.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 383' ' ' LEU . 13.3 mt -67.54 -32.91 74.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -79.54 -44.24 21.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -33.97 75.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.32 -69.1 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.071 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.32 61.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.434 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 23.8 pt -137.5 164.67 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 0.0 111.116 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 p -72.32 152.43 42.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.435 ' HG2' HD22 ' A' ' 405' ' ' LEU . 5.6 mt-30 -62.42 -31.11 71.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.27 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.4 t -79.73 -40.9 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.566 ' CE2' HG13 ' A' ' 379' ' ' VAL . 48.1 t80 -68.21 -50.33 54.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.74 -37.55 82.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 22.2 ttt-85 -60.63 -41.22 94.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.832 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.406 ' HB ' ' CE1' ' A' ' 432' ' ' PHE . 26.9 m -85.89 -30.4 6.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.84 -65.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.495 ' CE1' HD12 ' A' ' 405' ' ' LEU . 3.8 p90 -143.47 102.62 3.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -68.61 97.49 0.8 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.829 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -142.07 -70.67 0.34 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.32 143.53 16.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.061 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -77.64 125.78 29.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.974 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 112.05 -28.47 9.26 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.428 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.03 -31.4 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.763 ' HA ' HD12 ' A' ' 408' ' ' ILE . 5.8 tt -59.21 -47.47 85.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -31.41 72.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.903 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -68.45 -39.57 81.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.988 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.6 mt -64.96 -35.7 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.031 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.62 -35.16 45.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.925 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -71.33 -42.89 67.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 60.29 34.3 20.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.975 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.38 142.83 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.11 149.71 89.67 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.99 -11.37 29.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.571 2.18 . . . . 0.0 112.585 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -68.62 -38.89 80.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.361 . . . . 0.0 110.966 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -99.78 -26.87 13.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -55.58 176.38 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.243 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 43.4 t -82.76 175.93 9.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.669 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -70.7 -31.05 67.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.856 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 m -58.84 -46.6 87.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.828 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.709 HD11 HG23 ' A' ' 408' ' ' ILE . 11.5 tp -65.03 -38.91 92.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 420' ' ' GLN . 2.6 mt -59.83 -31.2 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.815 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.6 t -74.11 -47.38 42.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.065 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -63.75 -42.46 97.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.13 -35.16 74.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -63.51 -39.15 93.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.03 89.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.54 -36.84 79.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -66.34 -46.94 75.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -60.63 -52.94 62.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.64 ' HE1' HD13 ' A' ' 443' ' ' ILE . 66.6 t80 -57.46 -40.62 78.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.987 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.32 -26.42 61.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -72.82 -28.2 62.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.87 149.24 55.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.924 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.7 161.49 4.4 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.602 2.201 . . . . 0.0 112.34 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.39 -31.51 72.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.08 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -71.01 -42.83 69.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.409 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 78.1 mtm-85 -64.56 -42.87 95.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.07 -34.44 78.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -67.35 -47.4 70.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.837 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.64 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.4 mt -63.57 -47.26 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 21.2 m-85 -60.77 -34.2 74.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.862 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.83 8.72 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.311 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.06 113.47 22.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.841 0.353 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.25 -61.51 1.93 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.1 mtm-85 -89.86 129.89 36.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.53 -33.28 71.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.856 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -87.62 -60.02 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.86 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 73.1 m -69.37 107.3 3.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.89 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.2 mp -100.88 -31.69 11.02 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.838 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -100.27 -64.18 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.902 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -59.86 162.6 5.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.171 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.098 179.931 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 4.9 p -137.05 -63.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.199 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.9 156.7 48.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.937 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.95 133.51 29.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.031 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.5 m -97.07 177.51 5.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.951 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 39.7 t -66.2 -15.47 63.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.17 -29.35 21.88 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.082 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.5 tp -59.87 -40.18 82.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.432 ' CD1' HG23 ' A' ' 375' ' ' ILE . 86.5 m-85 -70.97 -38.3 72.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -71.49 -31.35 67.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.432 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 44.2 m0 -65.48 -44.44 87.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.791 HG13 ' CE1' ' A' ' 393' ' ' PHE . 22.0 t -68.64 -43.11 83.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.074 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 34.5 mtt180 -60.38 -44.62 95.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.87 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -69.46 -37.23 77.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -43.68 94.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 59.4 mt -60.41 -38.2 83.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.833 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -78.36 -31.82 48.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 11.5 mtt-85 -64.87 -65.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -74.12 -30.87 62.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.181 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 76.52 45.82 13.13 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.522 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 27.7 pt -108.11 165.07 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.82 0.343 . . . . 0.0 111.179 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 43.8 m -81.67 154.03 26.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.515 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.0 mt-30 -60.39 -29.2 68.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.995 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.97 -45.09 87.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.504 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.2 t -70.66 -49.9 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.791 ' CE1' HG13 ' A' ' 379' ' ' VAL . 37.5 t80 -61.87 -41.02 97.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.9 70.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.161 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -48.18 16.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.924 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.7 m -73.79 -29.1 25.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.225 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.78 -60.96 2.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.131 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 398' ' ' PHE . . . . . 0.546 ' CD2' ' ND2' ' A' ' 425' ' ' ASN . 16.1 p90 -146.89 105.88 3.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -74.29 100.67 3.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.35 -69.38 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.2 p -153.03 134.04 14.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.156 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.47 139.75 45.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 99.35 -24.59 31.6 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.581 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.6 tp -62.75 -36.16 82.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.515 HD22 ' HG2' ' A' ' 390' ' ' GLN . 9.1 tt -58.56 -46.85 86.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.028 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -28.85 66.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.965 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -78.71 -41.68 30.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 422' ' ' LEU . 19.3 mt -65.7 -38.9 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 409' ' ' LEU . 13.5 mt -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.982 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -69.45 -31.42 69.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 20.3 mttp -85.2 -45.84 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 61.28 31.95 19.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.814 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.24 169.96 9.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.08 130.37 26.31 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.832 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.639 ' HG3' HD13 ' A' ' 426' ' ' LEU . 52.2 Cg_exo -52.66 -25.92 27.9 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.465 2.11 . . . . 0.0 112.364 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -58.13 -33.75 69.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.999 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 8.9 t -111.32 -19.82 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.353 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -53.78 173.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.9 0.381 . . . . 0.0 111.311 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 53.0 m -81.25 -179.78 7.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.751 ' HA ' HD12 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -72.74 -36.93 67.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.846 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -46.23 88.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.879 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.745 HD11 HG23 ' A' ' 408' ' ' ILE . 3.2 tp -61.83 -39.9 93.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.751 HD12 ' HA ' ' A' ' 420' ' ' GLN . 13.2 mt -59.07 -32.88 70.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.738 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 420' ' ' GLN . 22.2 t -77.67 -34.91 20.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.04 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 425' ' ' ASN . . . . . 0.546 ' ND2' ' CD2' ' A' ' 398' ' ' PHE . 5.9 m120 -72.37 -47.32 50.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.918 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.639 HD13 ' HG3' ' A' ' 415' ' ' PRO . 25.1 mt -61.57 -34.89 76.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.785 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.3 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.79 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.49 87.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.989 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.1 mtp -64.79 -35.67 81.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.808 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -62.86 -45.9 90.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.763 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -61.95 -42.96 99.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.812 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.476 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.1 t80 -63.03 -44.05 97.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.77 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.42 HD13 ' HB3' ' A' ' 378' ' ' TRP . 22.6 mt -71.58 -25.82 62.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.041 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -69.88 -29.38 66.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.95 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 60.3 mt -58.94 154.81 36.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.968 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.27 162.87 38.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.624 2.216 . . . . 0.0 112.275 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -59.63 -37.21 78.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.74 -38.93 92.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.08 -41.77 58.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.488 ' HA ' HD12 ' A' ' 443' ' ' ILE . 66.8 mtm180 -59.81 -45.82 91.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -62.44 -39.06 92.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -62.81 -35.55 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 440' ' ' ARG . 8.7 mt -76.48 -34.12 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.06 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -66.16 -54.07 29.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -60.7 -37.8 82.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.955 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -72.92 97.94 2.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -127.71 143.85 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.947 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.84 30.84 3.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -95.46 -62.49 1.29 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.961 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.88 31.84 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.929 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 451' ' ' SER . . . . . 0.468 ' C ' HD12 ' A' ' 452' ' ' LEU . 1.3 m -74.34 109.6 7.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.468 HD12 ' C ' ' A' ' 451' ' ' SER . 10.9 mp -122.39 49.04 1.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -59.59 116.88 4.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.899 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -74.64 -62.54 1.5 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.149 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.909 . . . . 0.0 111.132 179.961 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.732 0.301 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.39 30.98 8.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.079 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -162.03 121.54 2.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 371' ' ' VAL . . . . . 0.648 HG11 HD23 ' A' ' 426' ' ' LEU . 21.8 t -114.52 113.63 44.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.191 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.787 ' O ' HG22 ' A' ' 375' ' ' ILE . 0.9 OUTLIER -100.04 -175.22 2.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -23.95 63.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.119 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.02 -28.55 62.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.787 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -58.01 -35.73 53.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.146 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -76.65 -40.36 49.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.864 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -69.46 -30.97 68.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.794 ' HB3' HD13 ' A' ' 433' ' ' LEU . 49.9 m0 -67.79 -43.07 80.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.952 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -58.82 -44.55 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.129 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -72.18 -49.11 38.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.975 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.9 -30.53 69.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.992 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -80.91 -38.49 27.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.995 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 HG13 ' A' ' 388' ' ' ILE . 7.1 mt -64.95 -40.41 94.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.969 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 -32.14 65.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.995 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.51 -31.35 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.06 -52.82 6.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 88.15 72.09 1.28 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.502 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.54 HD13 ' CE1' ' A' ' 444' ' ' TYR . 21.4 pt -148.77 173.59 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 111.158 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 3.2 m -90.41 152.6 20.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.5 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.57 -30.82 70.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.862 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.64 98.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.127 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.587 ' O ' HG22 ' A' ' 396' ' ' VAL . 32.8 t -70.61 -48.21 59.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.161 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -58.28 -48.65 79.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.416 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -60.53 -30.71 69.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -76.0 -55.28 5.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.867 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 392' ' ' VAL . 23.9 m -67.04 -27.91 41.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.211 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -77.4 -73.85 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -128.92 113.08 14.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -78.8 90.54 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 400' ' ' ARG . . . . . 0.621 ' O ' HG23 ' A' ' 401' ' ' THR . 7.4 tpt180 -132.77 -66.19 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 401' ' ' THR . . . . . 0.621 HG23 ' O ' ' A' ' 400' ' ' ARG . 1.0 OUTLIER -163.84 155.67 16.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 8.3 tm0? -85.19 137.69 32.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.7 -27.57 17.2 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.78 -31.49 69.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 110.932 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.613 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.7 tt -60.44 -48.46 81.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 9.5 m -61.54 -38.66 88.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -40.68 90.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.002 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.4 mt -67.7 -37.28 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.118 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 91.9 mt -79.22 -27.69 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.998 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.68 -31.01 64.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -69.05 -42.81 75.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 61.25 27.59 17.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.979 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.0 161.6 13.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.864 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.0 142.78 25.26 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.979 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 49.9 Cg_exo -54.85 -19.86 20.6 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.38 2.053 . . . . 0.0 112.584 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -49.17 -27.98 4.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.327 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 p -125.02 20.95 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.453 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -100.19 -173.02 2.32 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.05 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.05 178.66 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.752 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 423' ' ' LEU . 1.1 tp-100 -70.03 -31.03 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 22.6 t -58.94 -49.94 75.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 18.2 tp -62.08 -38.32 88.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 420' ' ' GLN . 50.0 mt -59.63 -30.81 68.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.815 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -71.98 -50.12 39.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.204 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -60.55 -44.04 96.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.648 HD23 HG11 ' A' ' 371' ' ' VAL . 7.9 mp -65.68 -31.54 72.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.22 -51.37 69.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.16 70.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -44.29 78.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 430' ' ' GLN . . . . . 0.429 ' HB2' HD13 ' A' ' 375' ' ' ILE . 8.5 tt0 -64.08 -44.96 90.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -60.36 -40.83 92.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.54 ' HA ' HD12 ' A' ' 435' ' ' LEU . 44.2 t80 -66.09 -33.6 76.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.785 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.794 HD13 ' HB3' ' A' ' 378' ' ' TRP . 13.4 mt -83.74 -27.74 28.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.998 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -74.9 -28.18 60.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.984 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.0 OUTLIER -56.92 161.89 4.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 436' ' ' PRO . . . . . 0.516 ' HD2' HD23 ' A' ' 435' ' ' LEU . 41.5 Cg_endo -67.33 148.39 79.74 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.513 2.142 . . . . 0.0 112.32 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.46 -31.29 69.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.963 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -46.07 90.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -45.16 68.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.961 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -58.19 -36.86 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.29 -37.58 87.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.811 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -75.0 -34.59 61.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.823 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 443' ' ' ILE . 9.8 mt -75.75 -10.88 13.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.459 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.54 ' CE1' HD13 ' A' ' 388' ' ' ILE . 4.8 m-85 -95.76 -29.63 14.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.2 -16.35 21.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.436 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 52.7 p-10 -68.64 71.05 0.2 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.928 0.394 . . . . 0.0 111.041 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.14 134.59 55.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.93 120.95 24.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.881 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -77.38 -8.46 57.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.343 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.01 -30.31 59.22 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.804 0.335 . . . . 0.0 111.003 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.3 t -65.56 -169.71 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.12 146.64 47.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.814 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -60.49 159.87 9.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -97.69 37.89 1.34 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.121 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.08 -179.973 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 10.6 m120 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.762 0.315 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.8 p -135.73 131.77 36.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.04 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -95.54 122.47 38.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.833 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.7 t -110.35 133.15 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 375' ' ' ILE . 5.0 m -99.8 163.1 12.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.2 t -66.31 -20.88 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.6 -27.53 11.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 111.199 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.7 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.9 tp -58.02 -44.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.109 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.591 ' HE1' HG22 ' A' ' 408' ' ' ILE . 76.9 m-85 -66.85 -40.83 88.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -66.91 -32.35 73.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.413 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.6 m0 -69.07 -46.75 67.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.933 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -60.53 -33.3 53.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.028 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -74.13 -43.55 57.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.813 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.21 -35.55 71.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.833 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.77 -36.49 78.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.891 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -35.83 79.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.851 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -72.46 -38.85 68.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -43.95 57.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.828 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.73 -32.02 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 64.54 30.81 78.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.512 HD13 ' CE1' ' A' ' 444' ' ' TYR . 42.6 pt -102.45 162.19 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.745 0.307 . . . . 0.0 111.154 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.42 151.78 42.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.57 ' HB3' HD22 ' A' ' 405' ' ' LEU . 52.8 mt-30 -62.76 -31.67 72.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.09 96.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.02 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -70.9 -43.12 77.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -61.99 -44.78 96.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.5 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -65.33 -30.56 71.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.138 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -72.86 -35.33 67.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -87.99 -31.48 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 397' ' ' ALA . . . . . 0.421 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -78.53 -63.03 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.086 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -140.12 98.42 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 97.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.919 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -136.37 -67.0 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 66.8 p -156.37 147.38 22.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.092 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.9 136.85 38.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 98.26 -27.42 19.43 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 9.8 tp -59.4 -36.03 75.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 409' ' ' LEU . 10.0 tt -59.88 -31.07 69.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.959 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 54.3 m -74.99 -44.92 45.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.98 -41.04 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.591 HG22 ' HE1' ' A' ' 376' ' ' TYR . 13.6 mt -69.38 -32.27 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.008 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.8 mm? -81.55 -30.67 33.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -44.1 61.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -45.52 91.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.952 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.99 31.3 19.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.34 151.72 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.05 146.57 63.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.94 -27.31 14.41 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.524 2.15 . . . . 0.0 112.405 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -58.39 -33.06 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.975 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 24.9 p -114.88 27.24 9.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.207 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.06 -169.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 18.5 m -99.59 173.13 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.884 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.6 mm100 -62.79 -47.58 82.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 6.3 p -59.31 -39.82 84.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.738 ' O ' HD13 ' A' ' 422' ' ' LEU . 3.2 tm? -68.82 -34.58 75.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.887 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.66 -35.43 67.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 420' ' ' GLN . 24.1 t -65.69 -47.41 86.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.028 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -65.54 -37.65 87.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.93 -35.28 78.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.37 -44.9 95.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.12 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.043 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 429' ' ' MET . . . . . 0.421 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 2.6 mtm -64.78 -36.37 84.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.863 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 430' ' ' GLN . . . . . 0.455 ' HG3' HD13 ' A' ' 375' ' ' ILE . 15.2 tt0 -67.95 -42.87 80.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.28 -40.95 97.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.468 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.9 t80 -62.97 -35.7 81.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.845 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 378' ' ' TRP . 11.3 mt -79.49 -26.63 41.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.934 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -70.0 -28.28 65.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.928 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.423 HD13 ' OE1' ' A' ' 439' ' ' GLU . 80.0 mt -57.98 155.3 24.67 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.97 163.5 35.46 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.559 2.173 . . . . 0.0 112.286 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -59.58 -31.47 69.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.52 75.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.192 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 439' ' ' GLU . . . . . 0.423 ' OE1' HD13 ' A' ' 435' ' ' LEU . 4.5 mm-40 -75.35 -51.61 12.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.406 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 6.2 mtp180 -58.76 -38.64 78.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.905 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.1 -47.99 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.951 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -39.8 77.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.033 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.468 HD13 ' HE1' ' A' ' 432' ' ' PHE . 18.0 mt -73.07 -45.36 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.14 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.512 ' CE1' HD13 ' A' ' 388' ' ' ILE . 16.2 m-85 -62.96 -49.95 72.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -28.41 67.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.28 77.01 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.939 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -177.89 148.05 0.5 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 40.4 mtt-85 -61.59 -76.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -99.96 172.72 7.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.894 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.98 -64.74 1.01 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 2.3 t -99.97 -66.53 0.9 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.995 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 452' ' ' LEU . 1.3 mp -65.37 154.24 38.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -140.05 117.67 11.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -71.74 157.88 37.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.177 -0.916 . . . . 0.0 111.128 179.997 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.847 0.356 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 6.6 t -173.04 142.49 1.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.15 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -91.13 151.19 21.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 371' ' ' VAL . . . . . 0.429 ' HB ' ' HG3' ' A' ' 415' ' ' PRO . 7.9 t -70.04 94.74 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.596 ' O ' HG22 ' A' ' 375' ' ' ILE . 67.5 m -62.78 -177.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.003 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.4 m -66.93 -22.35 65.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.054 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 374' ' ' GLU . . . . . 0.435 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 36.5 mt-10 -51.02 -27.39 7.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.175 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.639 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.4 tp -59.58 -44.89 94.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.575 ' HE1' HG22 ' A' ' 408' ' ' ILE . 88.5 m-85 -65.74 -36.87 84.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.04 -31.01 68.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.435 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.1 m0 -72.05 -45.91 58.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.779 HG22 HD11 ' A' ' 433' ' ' LEU . 30.4 t -60.47 -33.57 54.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.033 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -69.3 -41.25 77.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -37.0 50.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.951 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -61.21 -39.14 89.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.963 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 26.8 mt -74.14 -32.2 63.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.21 -31.56 62.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.967 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 16.0 mmt85 -77.96 -62.2 1.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.35 84.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.111 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 69.82 64.39 2.94 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.448 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.452 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 25.2 pt -131.56 157.28 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.759 0.314 . . . . 0.0 111.181 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 389' ' ' SER . . . . . 0.666 ' OG ' HG23 ' A' ' 392' ' ' VAL . 4.9 p -65.0 157.07 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 390' ' ' GLN . . . . . 0.433 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -68.13 -34.55 76.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.872 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.71 -30.88 69.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.108 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.666 HG23 ' OG ' ' A' ' 389' ' ' SER . 30.0 t -77.1 -50.66 20.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 393' ' ' PHE . . . . . 0.414 ' HA ' HG22 ' A' ' 396' ' ' VAL . 16.2 t80 -64.68 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.65 -41.79 87.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.167 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -47.65 70.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.847 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 392' ' ' VAL . 35.7 m -69.43 -37.89 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.186 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -72.27 -70.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -134.49 113.28 11.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.857 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -60.34 96.54 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.86 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -147.79 178.82 8.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.759 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.01 151.0 46.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -67.95 149.24 50.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.946 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.29 -27.72 15.92 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.542 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.87 -34.09 74.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.834 0.35 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 408' ' ' ILE . 4.3 tt -59.76 -50.44 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.8 p -60.27 -30.64 69.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -71.49 -33.22 69.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.957 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.9 mt -77.2 -36.25 24.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.489 HD23 HD23 ' A' ' 405' ' ' LEU . 4.0 mm? -74.09 -35.18 64.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -55.66 5.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -60.07 -48.41 81.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.878 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 60.13 30.96 20.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.989 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.8 115.68 6.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.49 149.17 84.64 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.429 ' HG3' ' HB ' ' A' ' 371' ' ' VAL . 94.1 Cg_endo -83.49 47.36 2.33 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.844 2.363 . . . . 0.0 112.823 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -100.15 -50.87 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 0.0 110.91 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.11 30.7 6.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -90.84 -177.48 4.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.087 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 419' ' ' SER . . . . . 0.6 ' O ' HD23 ' A' ' 423' ' ' LEU . 0.3 OUTLIER -87.5 178.58 6.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 179.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.893 ' O ' HG23 ' A' ' 424' ' ' VAL . 74.3 mt-30 -75.14 -30.22 60.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.964 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -50.5 73.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.089 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 56.0 tp -64.72 -41.43 95.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 419' ' ' SER . 3.7 mm? -58.65 -38.87 79.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 420' ' ' GLN . 32.2 t -67.52 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -42.33 54.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.786 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.18 -42.3 99.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.795 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -60.53 -40.92 93.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.29 99.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.063 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.9 mtm -70.14 -34.93 73.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.822 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -69.02 -47.09 66.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.715 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -59.64 -37.59 79.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.503 ' HA ' HD12 ' A' ' 435' ' ' LEU . 3.5 t80 -67.88 -44.55 76.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.779 HD11 HG22 ' A' ' 379' ' ' VAL . 18.2 mt -72.49 -33.22 66.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.811 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -69.89 -31.61 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.786 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 432' ' ' PHE . 14.3 mt -59.15 159.86 13.6 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.49 148.29 87.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.464 2.109 . . . . 0.0 112.32 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.7 -30.03 67.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.994 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -57.82 -40.48 80.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.119 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -51.81 23.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.448 ' HA ' HD12 ' A' ' 443' ' ' ILE . 86.7 mtm-85 -59.72 -30.79 69.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -55.54 31.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.932 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.76 -43.99 97.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.976 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.481 HD13 ' HE1' ' A' ' 432' ' ' PHE . 24.4 mt -58.93 -30.68 43.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.048 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.452 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 15.0 m-85 -87.47 -38.25 16.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.832 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -100.12 27.7 5.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -77.42 -175.4 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.76 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -108.07 114.51 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -65.53 78.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.791 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -94.23 -176.03 3.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.1 57.32 4.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.846 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 2.9 p -95.52 43.71 1.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -147.96 117.46 7.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.903 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -117.48 42.03 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.81 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -77.28 138.14 39.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.995 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.863 0.363 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 3.8 t -98.07 -32.54 11.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.1 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -90.42 166.59 13.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 30.8 t -103.58 109.7 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 375' ' ' ILE . 1.6 m -95.1 -176.69 3.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.951 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 66.4 m -66.61 -20.92 66.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.222 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -51.74 -29.62 19.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.877 0.37 . . . . 0.0 111.167 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 372' ' ' SER . 1.0 OUTLIER -59.43 -44.23 92.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.11 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 376' ' ' TYR . . . . . 0.476 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.9 m-85 -62.93 -48.77 77.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -32.25 68.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.754 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 54.4 m0 -64.1 -48.62 75.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.086 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 23.2 t -57.27 -42.12 79.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.353 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -60.58 -44.19 96.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -73.4 -41.84 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -42.37 95.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.048 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 383' ' ' LEU . 15.0 mt -60.32 -49.47 77.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.861 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -70.03 -37.89 75.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -67.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.04 -45.34 93.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.191 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 84.92 72.88 1.28 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.429 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 388' ' ' ILE . . . . . 0.421 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 19.5 pt -148.41 156.17 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.833 0.349 . . . . 0.0 111.127 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.01 152.96 42.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.895 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.34 -30.07 69.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.868 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -58.52 -38.19 77.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.144 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 392' ' ' VAL . . . . . 0.626 ' O ' HG22 ' A' ' 396' ' ' VAL . 30.2 t -77.9 -50.51 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.006 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -58.2 -35.02 71.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.014 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.76 61.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.087 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -31.26 41.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.8 m -89.0 -27.9 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.181 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -76.58 -61.6 1.91 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -146.13 119.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.894 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -76.45 101.4 5.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.29 -65.9 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.65 155.78 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.054 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.09 -32.98 39.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.945 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.29 27.16 18.14 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.56 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 13.6 tp -100.09 -38.17 8.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 405' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 409' ' ' LEU . 2.1 tt -59.47 -33.71 71.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 30.8 t -76.73 -31.58 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.889 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.4 -35.61 75.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 408' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 405' ' ' LEU . 9.9 mt -69.85 -40.49 78.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 409' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 405' ' ' LEU . 4.7 mt -75.98 -31.01 58.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.898 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -71.01 -37.9 72.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.35 -39.48 78.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 61.06 29.73 19.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 136.62 32.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.21 147.23 37.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.561 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 51.3 Cg_exo -52.86 -23.48 21.05 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.415 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -54.64 -29.78 53.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.065 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -130.86 19.75 5.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.297 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 418' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -91.13 163.64 14.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.196 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 3.1 p -80.02 -178.12 6.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.84 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 420' ' ' GLN . . . . . 0.459 ' O ' HG23 ' A' ' 424' ' ' VAL . 6.5 tt0 -69.42 -43.89 72.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 15.8 m -58.51 -34.15 70.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 422' ' ' LEU . . . . . 0.696 HD13 ' O ' ' A' ' 422' ' ' LEU . 2.9 tm? -71.88 -38.13 70.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 35.8 mt -64.68 -40.4 95.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 424' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 420' ' ' GLN . 42.3 t -66.38 -46.12 87.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.05 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -60.52 -41.5 94.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.48 -33.82 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.975 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -60.86 -44.47 96.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.82 76.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.0 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.5 ttm -68.05 -43.09 79.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -60.68 -47.97 83.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 432' ' ' PHE . . . . . 0.545 ' HA ' HD12 ' A' ' 435' ' ' LEU . 22.9 t80 -61.43 -41.6 97.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 42.1 mt -73.71 -28.38 61.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.022 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -69.97 -38.85 76.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 5.9 mt -60.7 145.27 88.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.059 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.12 164.72 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.574 2.183 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.72 -33.41 75.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.48 81.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.021 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -50.5 41.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.715 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 440' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 88.2 mtm-85 -57.75 -36.02 71.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.784 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -54.16 49.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.09 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 10.0 mtp-105 -58.86 -47.87 83.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 443' ' ' ILE . . . . . 0.523 HD12 ' HE1' ' A' ' 432' ' ' PHE . 56.0 mt -60.27 -28.74 42.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 444' ' ' TYR . . . . . 0.421 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.9 m-85 -72.91 -44.21 61.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -100.05 21.81 12.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.476 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 48.8 p-10 -78.95 61.3 3.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 110.99 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -127.63 32.28 5.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.47 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -60.31 -39.73 88.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.39 -33.38 15.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 58.7 m -85.83 57.04 4.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -141.93 96.62 3.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -98.86 27.96 4.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.073 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -100.0 -49.87 4.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.07 -179.969 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . 0.473 HG12 ' HG2' ' A' ' 415' ' ' PRO . 21.5 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 111.098 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.1 m -100.02 179.39 4.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.9 -19.37 65.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.199 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.0 mt-10 -51.7 -27.13 10.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.202 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.568 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.3 tp -57.7 -43.65 84.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.998 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.469 ' N ' HG23 ' A' ' 375' ' ' ILE . 96.6 m-85 -72.06 -38.16 69.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.785 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -32.95 73.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.427 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.7 m0 -65.07 -43.91 90.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -58.53 -41.11 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.62 -37.21 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.56 -39.44 62.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.72 -36.68 81.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.07 -37.42 72.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -78.12 -31.4 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -53.46 7.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.931 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -67.39 -47.08 71.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 82.55 61.03 2.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.506 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.629 HD13 ' CE1' ' A' ' 444' ' ' TYR . 22.8 pt -134.46 166.2 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.813 0.339 . . . . 0.0 111.153 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.46 157.31 34.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -64.1 -31.45 72.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . 0.413 ' HB2' ' OE1' ' A' ' 402' ' ' GLN . . . -60.63 -35.95 77.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.076 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 396' ' ' VAL . 23.3 t -75.33 -56.56 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.068 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.421 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -59.1 -30.53 68.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -76.75 -29.93 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.268 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -81.55 -31.07 32.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.985 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.8 m -88.47 -27.15 5.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.274 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -80.35 -52.43 7.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.072 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.454 ' HE1' HD12 ' A' ' 405' ' ' LEU . 3.0 p90 -154.92 89.26 1.22 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.886 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.55 120.34 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 401' ' ' THR . 0.3 OUTLIER -161.91 -72.14 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.819 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.3 OUTLIER -164.29 129.97 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.051 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 391' ' ' ALA . 0.5 OUTLIER -63.46 151.43 41.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.822 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.46 -28.01 14.98 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.458 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.468 ' HG ' HD11 ' A' ' 408' ' ' ILE . 12.7 tp -66.52 -39.81 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.861 0.362 . . . . 0.0 110.939 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.521 HD21 HD12 ' A' ' 409' ' ' LEU . 7.4 tt -58.74 -29.48 66.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.029 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.9 t -68.93 -43.0 75.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -69.74 -37.46 76.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.654 HG23 HD21 ' A' ' 422' ' ' LEU . 16.4 mt -69.37 -34.08 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.232 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.521 HD12 HD21 ' A' ' 405' ' ' LEU . 3.4 mt -81.59 -31.81 32.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -66.31 -48.65 69.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.835 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -67.87 -47.58 68.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.95 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 61.21 30.0 19.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.6 136.39 55.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -74.22 144.35 81.52 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.473 ' HG2' HG12 ' A' ' 371' ' ' VAL . 52.7 Cg_exo -52.66 -27.35 33.04 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.565 2.177 . . . . 0.0 112.231 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -38.14 77.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.974 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 m -120.73 30.55 6.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 167.41 10.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 37.5 m -85.38 175.02 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.857 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.531 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.9 mt-30 -62.74 -51.28 67.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.86 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 4.0 t -59.3 -30.82 68.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.654 HD21 HG23 ' A' ' 408' ' ' ILE . 2.7 tm? -71.42 -44.18 65.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.17 -36.99 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.945 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -69.5 -33.07 55.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.241 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.54 -48.16 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 422' ' ' LEU . 16.1 mt -68.24 -32.74 73.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -43.64 97.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.956 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -70.85 -40.22 72.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.143 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.4 mtt -63.42 -31.4 72.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.939 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -70.23 -46.66 64.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -60.19 -35.91 76.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.37 -38.13 77.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.93 -31.69 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -72.75 -29.6 63.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.35 159.87 10.78 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.89 151.76 73.79 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.626 2.217 . . . . 0.0 112.311 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.06 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.79 -38.77 79.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.46 -48.13 51.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 42.3 mtm180 -59.48 -34.07 72.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.932 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -64.57 -41.14 96.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.6 -33.6 74.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.87 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 20.4 mt -77.51 -40.63 28.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.068 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.629 ' CE1' HD13 ' A' ' 388' ' ' ILE . 9.5 m-85 -66.19 -35.34 80.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.962 0.41 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.878 -179.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.856 0.36 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.697 ' O ' HG22 ' A' ' 375' ' ' ILE . 64.3 m -86.29 173.01 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.935 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 55.0 m -62.18 -24.11 67.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.123 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -53.28 -27.65 23.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.781 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.9 tp -57.99 -37.49 61.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.051 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.443 ' OH ' HD21 ' A' ' 426' ' ' LEU . 88.8 m-85 -75.69 -42.69 50.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.887 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.85 -31.15 72.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.927 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.403 ' HB3' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -71.01 -44.28 66.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 375' ' ' ILE . 29.5 t -59.48 -33.87 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -76.46 -45.52 30.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -67.4 -40.24 85.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.004 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -31.69 70.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.982 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.4 mt -71.11 -32.03 68.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.979 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.36 -31.18 17.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.919 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -80.13 -32.9 38.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -80.32 -53.29 6.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.102 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 93.64 59.32 1.21 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.511 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.447 HD13 ' CE1' ' A' ' 444' ' ' TYR . 16.7 pt -140.34 179.23 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.918 0.389 . . . . 0.0 111.067 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.09 149.76 21.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.99 -29.6 65.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.051 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.4 -49.0 79.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.873 ' O ' HG22 ' A' ' 396' ' ' VAL . 25.3 t -66.28 -50.53 67.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.127 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.526 ' CE1' HG13 ' A' ' 379' ' ' VAL . 14.0 t80 -57.78 -30.98 66.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.019 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.47 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -82.77 -30.28 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.72 -31.24 36.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.91 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.873 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.6 m -86.05 -30.03 6.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.198 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.25 -43.14 24.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.086 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.443 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 14.3 p90 -166.98 111.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.74 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.53 124.82 20.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . 0.409 ' N ' ' HD3' ' A' ' 400' ' ' ARG . 0.0 OUTLIER -160.74 -177.42 6.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.954 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -84.2 144.38 29.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.029 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.5 139.27 55.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 105.11 -27.61 17.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.502 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.422 ' HG ' HD11 ' A' ' 408' ' ' ILE . 4.8 tp -64.08 -55.88 18.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 408' ' ' ILE . 0.5 OUTLIER -59.02 -32.81 70.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.966 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.18 -30.49 68.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.851 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -39.22 21.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 405' ' ' LEU . 10.1 mt -65.61 -34.58 71.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 8.4 mt -78.74 -31.47 46.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.786 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -72.5 -44.29 62.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -60.23 -49.39 77.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.856 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.44 31.23 20.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.906 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -85.12 151.12 24.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.91 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.52 144.14 80.31 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.13 -4.32 15.21 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.529 2.153 . . . . 0.0 112.673 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -56.86 -46.39 81.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.747 0.308 . . . . 0.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 p -109.29 31.67 5.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.167 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.79 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -99.99 164.55 11.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.18 174.19 11.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.834 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.664 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -64.8 -39.35 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.2 p -58.73 -41.02 85.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.79 HD23 ' CB ' ' A' ' 418' ' ' ALA . 19.8 tp -69.04 -31.24 69.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.879 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.21 -44.51 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.8 t -59.7 -43.73 92.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -67.98 -44.72 76.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.443 HD21 ' OH ' ' A' ' 376' ' ' TYR . 6.8 mp -67.1 -39.84 86.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.946 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -60.44 -41.1 93.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.867 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.102 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.36 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.43 -38.04 71.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.809 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.53 -42.91 95.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.563 ' HA ' HD12 ' A' ' 435' ' ' LEU . 24.3 t80 -62.37 -46.42 88.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 378' ' ' TRP . 34.0 mt -65.53 -29.74 70.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.01 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -70.06 -29.62 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.936 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 432' ' ' PHE . 35.9 mt -58.49 147.9 67.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.86 158.76 5.91 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.576 2.184 . . . . 0.0 112.224 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.53 -31.46 72.68 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.894 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -68.28 -35.1 77.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -75.44 -39.57 58.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.906 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -59.75 -42.17 92.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.53 81.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -42.04 90.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.87 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 29.6 mt -74.76 -29.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.203 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.447 ' CE1' HD13 ' A' ' 388' ' ' ILE . 5.9 m-85 -69.51 -46.59 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.887 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.959 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . 0.614 HG11 HD23 ' A' ' 426' ' ' LEU . 21.3 t . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.841 0.353 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.566 ' O ' HG22 ' A' ' 375' ' ' ILE . 18.1 m -94.95 -178.44 4.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.014 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -19.72 64.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.093 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -54.0 -27.9 34.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.214 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.662 ' O ' HG23 ' A' ' 379' ' ' VAL . 0.9 OUTLIER -58.57 -39.32 75.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.123 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.497 ' CD1' HG23 ' A' ' 375' ' ' ILE . 34.3 m-85 -76.63 -34.36 58.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.995 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -30.82 63.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.0 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -68.34 -46.61 69.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.28 -39.66 79.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.172 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -68.97 -39.02 79.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -74.46 -32.48 62.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.907 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -71.03 -47.85 56.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.59 -34.28 73.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -69.87 -31.71 69.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -44.05 17.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.95 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -68.79 -55.01 12.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.085 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.9 31.61 9.13 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 17.2 pt -109.86 164.02 6.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.81 0.338 . . . . 0.0 111.09 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 152.4 41.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -31.11 69.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.91 96.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.134 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.5 t -63.41 -51.9 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -61.68 -31.15 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -74.63 -32.19 62.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.9 ttt85 -72.26 -42.44 65.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.942 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.4 m -78.03 -33.7 18.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.19 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.86 -72.24 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.11 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.491 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 3.3 p90 -131.79 114.57 14.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.32 88.8 3.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.923 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -143.92 -74.62 0.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 36.9 p -148.7 171.02 16.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.0 -33.36 10.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.991 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.89 -27.47 72.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.623 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' ' 408' ' ' ILE . 33.3 tp -60.84 -46.02 92.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 394' ' ' ALA . 5.7 tt -56.95 -32.09 65.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.062 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -29.69 40.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.86 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -31.87 59.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.031 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.699 HD11 ' HG ' ' A' ' 404' ' ' LEU . 8.0 mt -73.56 -45.08 52.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.091 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.16 -44.62 62.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.045 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -62.4 -30.72 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.983 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -82.5 -44.51 15.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 61.55 30.51 18.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -86.97 164.86 16.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.786 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -93.18 151.97 40.87 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.39 -22.2 29.53 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.598 2.199 . . . . 0.0 112.457 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -29.95 60.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.155 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 67.9 p -100.91 -31.0 11.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.756 ' CB ' HD13 ' A' ' 422' ' ' LEU . . . -60.37 171.15 1.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.05 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.18 171.76 13.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.91 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.489 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.4 tt0 -59.77 -31.74 69.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 p -58.75 -45.88 88.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.756 HD13 ' CB ' ' A' ' 418' ' ' ALA . 4.8 tt -62.55 -37.53 86.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.98 -31.81 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.782 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -71.25 -44.08 73.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.199 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -73.8 -43.6 58.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.703 HD13 HD21 ' A' ' 422' ' ' LEU . 3.8 tp -60.65 -49.2 78.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.911 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -32.18 70.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.724 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.96 92.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.972 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . 0.451 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 41.1 mtt -62.5 -42.11 99.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.54 -41.3 96.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.836 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -60.31 -52.61 64.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.938 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 443' ' ' ILE . 19.9 t80 -59.23 -46.27 88.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.74 -31.54 72.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.891 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -71.16 -28.37 64.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.018 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 82.9 mt -57.1 153.06 26.33 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.971 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.87 146.87 27.11 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.606 2.204 . . . . 0.0 112.386 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -64.76 -34.01 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.886 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.66 75.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.108 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -51.1 17.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.871 ' HA ' HD12 ' A' ' 443' ' ' ILE . 78.7 mtm180 -58.92 -29.48 67.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -46.92 69.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.171 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -65.75 -29.34 69.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.067 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 440' ' ' ARG . 11.2 mt -73.03 -36.78 51.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.87 0.367 . . . . 0.0 111.026 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -71.38 -31.67 67.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.917 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 27.7 t . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.735 0.302 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.685 ' O ' HG22 ' A' ' 375' ' ' ILE . 14.4 m -86.55 -174.96 5.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 63.4 p -71.88 -23.96 61.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.037 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.6 mt-10 -54.18 -27.2 32.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.139 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.685 HG22 ' O ' ' A' ' 372' ' ' SER . 8.3 tp -57.9 -40.95 78.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.138 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.418 ' N ' HG23 ' A' ' 375' ' ' ILE . 93.7 m-85 -73.93 -34.13 64.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -71.65 -33.07 68.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.421 ' HB3' HD22 ' A' ' 433' ' ' LEU . 53.9 m0 -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 375' ' ' ILE . 31.8 t -60.26 -47.6 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.066 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -40.85 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.803 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.25 -34.7 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.925 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.94 -41.92 73.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 383' ' ' LEU . 12.3 mt -65.91 -44.41 85.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -39.5 89.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -67.17 -51.8 49.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.909 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -66.46 -62.17 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.078 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.52 28.42 7.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.502 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 10.4 pt -100.8 166.71 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 75.1 m -79.39 159.35 27.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.477 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.09 -31.49 70.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -63.26 -38.93 93.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.148 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.506 ' O ' HG22 ' A' ' 396' ' ' VAL . 27.5 t -75.7 -34.51 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 33.1 t80 -73.67 -43.17 60.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.946 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.85 -32.32 72.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -68.56 -55.4 11.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.0 m -64.42 -35.87 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.117 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -71.98 -69.15 0.41 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.205 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.7 p90 -139.68 110.68 6.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.969 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.6 93.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.66 -165.47 2.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.801 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.86 131.09 43.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -59.01 -32.23 69.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.082 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.65 -20.6 77.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.703 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.512 ' HG ' HD11 ' A' ' 408' ' ' ILE . 24.0 tp -64.77 -48.02 76.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.915 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.8 tt -57.88 -36.65 72.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.065 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.8 p -67.15 -29.89 69.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -80.1 -35.83 36.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.956 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.915 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -66.29 -37.1 78.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.058 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.13 -32.52 33.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -71.07 -49.58 43.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -73.57 -33.7 64.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.93 31.09 20.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . 0.417 ' OE2' HG23 ' A' ' 417' ' ' THR . 9.1 tp10 -64.19 98.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.02 155.45 54.58 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.869 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.567 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 34.3 Cg_endo -64.31 -19.25 65.46 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.656 2.237 . . . . 0.0 112.464 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -58.26 -29.53 65.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.02 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . 0.417 HG23 ' OE2' ' A' ' 413' ' ' GLU . 9.0 t -133.91 19.15 3.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.489 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.567 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -93.68 146.43 23.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.48 179.04 0.65 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.907 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.569 ' O ' HG23 ' A' ' 424' ' ' VAL . 7.4 mm-40 -66.7 -39.32 88.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.051 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -45.14 93.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.746 ' O ' HD13 ' A' ' 422' ' ' LEU . 3.3 tm? -62.13 -33.02 73.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.802 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.53 -32.55 72.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -67.43 -51.1 55.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.142 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -63.44 -36.49 83.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.004 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.12 -38.81 79.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -63.32 -39.86 95.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.3 -38.72 92.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.112 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 3.1 ttm -67.97 -33.66 75.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.855 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -70.25 -39.92 74.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.81 -50.38 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.945 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.65 ' HE1' HD13 ' A' ' 443' ' ' ILE . 68.9 t80 -55.53 -41.39 73.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 378' ' ' TRP . 2.2 mt -68.66 -28.78 67.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -82.48 -22.24 35.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.16 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 34.3 mt -53.93 148.79 19.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.096 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 152.13 16.2 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.578 2.185 . . . . 0.0 112.38 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.53 -36.21 81.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.856 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.06 85.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . 0.447 ' O ' HD12 ' A' ' 443' ' ' ILE . 0.5 OUTLIER -73.34 -40.08 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.928 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.407 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 50.6 mtm-85 -59.45 -46.56 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -43.47 96.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.908 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -50.56 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.978 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.65 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.1 mt -60.62 -30.65 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 16.4 m-85 -75.79 -40.79 54.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.893 -179.933 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.233 0.184 0 CA-C-O 120.801 0.334 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.557 ' O ' HG22 ' A' ' 375' ' ' ILE . 69.3 m -90.57 166.38 13.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.912 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 6.2 m -59.38 -21.74 60.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.414 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.2 mt-10 -53.4 -27.78 26.01 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.189 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.8 tp -58.72 -45.02 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.105 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.484 ' N ' HG23 ' A' ' 375' ' ' ILE . 69.9 m-85 -66.23 -38.95 89.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.799 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -31.03 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.817 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.678 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.0 m0 -68.44 -42.14 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.04 -51.05 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.19 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -60.53 -48.94 79.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.57 -35.88 82.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -64.86 -47.03 79.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 69.5 mt -60.91 -44.55 96.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -60.22 -31.58 70.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.003 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -85.41 -38.49 18.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.8 -55.62 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.056 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.09 52.16 3.53 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 22.7 pt -131.24 179.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.824 0.345 . . . . 0.0 111.153 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -89.88 154.49 19.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -31.09 69.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.23 94.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.158 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.659 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.1 t -71.89 -31.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.185 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -75.28 -43.96 48.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.003 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.98 78.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.112 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.91 -59.5 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.874 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.6 m -59.87 -39.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.013 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . 0.438 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -66.13 -72.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.075 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.8 p90 -130.4 97.31 4.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.834 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -60.14 109.73 1.04 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.971 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . 0.716 ' O ' HG23 ' A' ' 401' ' ' THR . 0.6 OUTLIER -154.24 -70.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.8 OUTLIER -169.4 170.65 8.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -97.12 131.56 43.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.8 -27.95 6.62 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.545 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.55 -45.8 85.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.797 ' CD2' HD12 ' A' ' 409' ' ' LEU . 7.2 tt -58.54 -41.74 86.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.014 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.5 m -64.41 -30.06 71.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -29.22 42.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.02 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.741 HG23 HD21 ' A' ' 422' ' ' LEU . 7.3 mt -80.37 -39.7 19.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.797 HD12 ' CD2' ' A' ' 405' ' ' LEU . 11.7 mt -76.99 -50.67 12.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.139 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -33.36 71.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.026 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -36.66 81.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 60.64 34.75 20.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -91.29 126.14 36.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -71.42 148.99 93.68 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.954 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.78 -8.39 22.99 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.579 2.186 . . . . 0.0 112.642 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -56.94 -39.42 74.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.793 0.33 . . . . 0.0 111.019 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 80.8 p -125.56 32.49 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.139 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.84 147.77 24.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.106 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 83.1 p -65.66 -178.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 424' ' ' VAL . 3.1 tt0 -72.74 -40.69 65.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 14.4 t -60.37 -43.02 96.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.741 HD21 HG23 ' A' ' 408' ' ' ILE . 3.3 tm? -63.86 -40.98 97.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.18 -30.76 68.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -70.01 -40.2 78.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.037 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -63.25 -37.11 85.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.854 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.726 HD11 ' CD1' ' A' ' 422' ' ' LEU . 13.9 mt -75.57 -32.04 60.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -54.1 43.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.896 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.5 86.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . 0.438 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 7.5 mtm -68.17 -35.5 78.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.851 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -65.75 -41.14 92.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.874 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -60.6 -40.3 91.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.598 ' HA ' HD12 ' A' ' 435' ' ' LEU . 34.8 t80 -64.18 -32.71 74.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.945 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 378' ' ' TRP . 37.4 mt -80.76 -28.75 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -70.0 -29.53 66.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.982 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.598 HD12 ' HA ' ' A' ' 432' ' ' PHE . 3.7 mt -58.75 151.54 52.68 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 156.76 6.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.546 2.164 . . . . 0.0 112.317 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -66.05 -37.75 86.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.943 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.89 71.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.077 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.92 -38.25 64.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.925 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 36.9 mtm-85 -59.59 -47.23 86.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.816 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.41 -37.46 85.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.84 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -37.14 86.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.428 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.5 mt -79.16 -40.83 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.014 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.405 ' HH ' ' HE2' ' A' ' 432' ' ' PHE . 15.8 m-85 -60.84 -43.17 98.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.841 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.913 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.78 0.324 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.598 ' O ' HG22 ' A' ' 375' ' ' ILE . 3.1 m -97.98 178.77 5.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.98 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.7 t -69.01 -21.14 64.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.118 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.74 -27.95 20.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.089 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.747 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.2 tp -58.38 -40.28 77.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.595 ' OH ' HD21 ' A' ' 426' ' ' LEU . 97.2 m-85 -74.79 -37.26 62.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.83 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -31.37 70.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.704 ' CB ' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -70.7 -42.05 71.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 375' ' ' ILE . 28.0 t -61.8 -48.29 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -49.6 65.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.901 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.75 -45.4 92.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.09 -41.12 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.51 HD23 HG13 ' A' ' 388' ' ' ILE . 5.8 mt -60.21 -31.51 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.962 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.37 -49.75 12.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 3.1 mtt-85 -62.66 -36.78 83.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -79.49 -30.53 42.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 65.5 66.96 2.2 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.482 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.51 HG13 HD23 ' A' ' 383' ' ' LEU . 16.4 pt -143.78 173.43 5.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.809 0.337 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.3 m -91.75 154.04 19.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.945 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.444 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.3 mt-30 -60.12 -30.24 69.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.896 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.31 -41.43 89.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.156 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.6 t -75.57 -51.95 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.38 -29.28 63.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -71.02 -46.36 62.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.2 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.04 -48.69 80.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.9 m -67.42 -27.99 40.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.208 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -85.06 -76.11 0.33 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.21 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.437 ' CE1' HD12 ' A' ' 405' ' ' LEU . 16.3 p90 -125.53 118.48 25.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -74.29 107.71 6.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.841 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . 0.645 ' HG3' HG22 ' A' ' 401' ' ' THR . 22.6 tpp180 -154.17 -70.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . 0.645 HG22 ' HG3' ' A' ' 400' ' ' ARG . 1.8 t -169.99 139.18 1.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -72.73 73.4 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.926 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -179.31 -37.51 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.9 tp -61.55 -29.07 69.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.444 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.8 tt -57.49 -37.1 72.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.968 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 89.1 p -72.71 -40.33 66.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.866 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.23 -42.13 99.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.821 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 422' ' ' LEU . 10.6 mt -67.88 -35.09 70.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 28.6 mt -76.21 -34.36 59.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -68.86 -41.7 78.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -60.44 -33.46 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 44.01 31.84 0.56 Allowed 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.406 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 135.34 33.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -67.2 144.7 98.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.489 ' HB3' HD22 ' A' ' 426' ' ' LEU . 85.7 Cg_endo -78.57 -0.66 10.92 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.538 2.159 . . . . 0.0 112.704 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -65.56 -37.02 85.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.987 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.1 p -123.56 25.93 8.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.269 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.506 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.03 174.9 5.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.119 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 70.2 m -69.76 171.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.819 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.797 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.1 pt20 -74.42 -32.01 62.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 16.7 m -61.17 -41.14 96.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.64 HD11 HG23 ' A' ' 408' ' ' ILE . 52.3 tp -69.11 -41.26 77.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.94 -31.68 70.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 420' ' ' GLN . 25.7 t -71.35 -47.63 58.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -64.56 -35.59 81.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.864 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.595 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.5 mp -67.1 -41.36 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.894 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -39.32 86.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.02 -44.12 97.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.9 mtt -63.26 -33.26 75.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.944 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -67.48 -42.39 83.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.15 -47.2 86.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.79 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.647 ' HE1' HD13 ' A' ' 443' ' ' ILE . 32.5 t80 -62.25 -31.15 71.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 378' ' ' TRP . 18.0 mt -84.59 -23.19 29.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.116 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -31.22 68.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.925 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.682 HD22 ' OE1' ' A' ' 439' ' ' GLU . 12.0 mt -64.98 154.88 85.46 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.74 156.14 59.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.482 2.121 . . . . 0.0 112.237 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -58.68 -30.96 67.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.942 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.37 94.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . 0.682 ' OE1' HD22 ' A' ' 435' ' ' LEU . 16.7 mt-10 -73.72 -37.15 65.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.895 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -59.79 -47.44 85.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.11 -41.35 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.647 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.2 mt -70.53 -32.95 51.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.134 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.427 ' CD1' HD13 ' A' ' 388' ' ' ILE . 14.2 m-85 -68.15 -39.64 82.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.941 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.874 0.369 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.656 ' O ' HG22 ' A' ' 375' ' ' ILE . 10.7 m -85.25 -177.07 6.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.785 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -25.88 61.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.8 mm-40 -54.79 -25.21 26.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.661 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.1 tp -56.99 -42.95 80.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.131 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.607 ' OH ' HD21 ' A' ' 426' ' ' LEU . 84.2 m-85 -72.63 -42.36 64.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.82 -31.31 72.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.826 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.442 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 35.6 m0 -67.46 -40.01 85.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -57.9 -59.44 3.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.11 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 45.1 mtt-85 -54.16 -34.91 61.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.99 -30.31 58.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . 0.457 ' OE1' HD21 ' A' ' 433' ' ' LEU . 4.6 tt0 -78.35 -36.17 46.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 393' ' ' PHE . 4.1 mm? -67.54 -44.39 78.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 52.2 tttt -69.76 -45.97 66.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.892 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.61 -54.84 41.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.94 -30.83 69.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.132 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 71.84 40.21 58.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.449 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 29.0 pt -125.37 176.86 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.162 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 95.1 p -91.61 155.42 18.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.989 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -59.19 -27.98 66.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.24 82.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.691 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.6 t -72.53 -31.32 37.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.425 ' CD2' HD21 ' A' ' 383' ' ' LEU . 71.6 t80 -73.39 -48.02 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.43 -36.99 76.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -67.35 -62.4 1.44 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.7 m -59.52 -29.45 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.168 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -75.26 -58.77 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.993 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.498 ' HE2' HD23 ' A' ' 404' ' ' LEU . 2.4 p90 -148.27 119.21 7.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.33 99.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -169.39 -168.07 0.77 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.736 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.47 149.36 33.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.053 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.91 -31.6 71.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -66.92 -25.86 73.19 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.553 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.498 HD23 ' HE2' ' A' ' 398' ' ' PHE . 6.7 tp -62.31 -50.36 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 0.0 111.005 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.433 HD21 HD12 ' A' ' 409' ' ' LEU . 7.1 tt -58.51 -38.35 77.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.052 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.3 p -68.6 -30.82 69.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.74 -31.41 52.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.996 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.72 HG23 HD11 ' A' ' 422' ' ' LEU . 9.9 mt -80.35 -30.81 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.987 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.433 HD12 HD21 ' A' ' 405' ' ' LEU . 5.0 mt -79.01 -34.62 43.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.832 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -67.79 -36.9 81.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 19.3 mmtm -60.12 -53.4 58.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 60.28 30.85 20.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -99.86 146.55 26.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.41 139.8 87.08 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.787 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -83.06 50.52 3.37 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.732 2.288 . . . . 0.0 112.606 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -100.05 -40.71 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.891 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.2 p -124.36 30.68 5.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.043 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.8 -169.62 2.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.116 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 57.8 m -90.17 172.27 8.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.777 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.9 OUTLIER -69.04 -31.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 92.3 p -59.62 -43.58 93.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.848 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.72 HD11 HG23 ' A' ' 408' ' ' ILE . 13.1 tp -68.21 -34.86 77.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.64 -39.56 84.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.777 HG23 ' O ' ' A' ' 420' ' ' GLN . 26.8 t -66.85 -44.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -64.92 -52.63 55.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.607 HD21 ' OH ' ' A' ' 376' ' ' TYR . 8.1 mp -59.93 -31.26 69.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -44.27 70.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.48 -45.8 82.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.1 mtp -59.85 -34.24 72.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -68.77 -32.4 72.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.49 -34.34 75.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.819 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -69.44 -35.58 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.457 HD21 ' OE1' ' A' ' 382' ' ' GLU . 2.5 mt -79.58 -30.77 41.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -72.79 -27.92 62.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.009 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.32 147.49 57.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.014 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.98 155.92 10.49 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.593 2.195 . . . . 0.0 112.249 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -66.23 -31.75 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.18 77.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.074 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -76.1 -40.17 53.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.864 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.494 ' HA ' HD12 ' A' ' 443' ' ' ILE . 62.2 mtm180 -70.86 -25.62 62.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.106 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.01 -49.5 50.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.062 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -41.91 99.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.094 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.494 HD12 ' HA ' ' A' ' 440' ' ' ARG . 15.8 mt -61.68 -50.17 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.994 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.403 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 12.5 m-85 -61.32 -30.97 70.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.938 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.839 179.915 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 29.0 t . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.831 0.348 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -70.12 169.22 13.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -16.71 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.217 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.433 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.1 mp0 -51.36 -28.15 11.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.762 0.315 . . . . 0.0 111.183 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.619 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.0 tp -58.51 -37.78 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.0 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.603 ' HE1' HG22 ' A' ' 408' ' ' ILE . 36.8 m-85 -73.51 -42.95 61.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.78 -32.17 73.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.99 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.433 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.9 m0 -66.28 -41.9 89.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.921 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 375' ' ' ILE . 32.5 t -61.15 -35.35 65.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.007 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.19 -31.39 65.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -73.8 -37.92 64.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . 0.563 ' OE2' ' HB2' ' A' ' 386' ' ' ALA . 1.2 tm-20 -76.2 -37.84 57.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.944 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.34 -31.2 71.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.907 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -86.65 -31.26 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.79 -67.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . 0.563 ' HB2' ' OE2' ' A' ' 382' ' ' GLU . . . -59.29 -41.94 90.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 74.18 70.88 1.18 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.488 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.409 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 21.1 pt -134.11 158.0 42.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.055 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.17 160.9 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.802 ' HG2' HD23 ' A' ' 405' ' ' LEU . 2.6 mt-30 -66.19 -31.43 72.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.854 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.59 69.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.212 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.826 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.5 t -84.01 -59.54 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.275 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -58.02 -26.84 62.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -81.05 -40.51 24.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.27 -39.64 59.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.169 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.826 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.4 m -71.61 -32.05 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.224 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -81.22 -66.51 0.88 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.456 ' CE1' ' HE2' ' A' ' 429' ' ' MET . 16.5 p90 -128.36 114.85 17.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -59.59 109.08 0.82 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -169.57 -172.38 1.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -69.84 132.13 45.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.139 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -63.93 154.61 33.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 95.01 -24.5 28.33 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -58.97 -41.11 86.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.791 0.329 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.802 HD23 ' HG2' ' A' ' 390' ' ' GLN . 2.2 tp -57.38 -33.77 68.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 8.0 t -65.41 -43.74 89.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.932 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -69.08 -41.92 76.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.008 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.603 HG22 ' HE1' ' A' ' 376' ' ' TYR . 25.7 mt -62.58 -40.49 88.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.013 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.463 HD23 ' HD1' ' A' ' 376' ' ' TYR . 58.7 mt -72.18 -37.01 69.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.021 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -44.02 73.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mmmt -58.82 -39.53 81.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.013 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 59.62 30.73 20.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -93.52 109.13 20.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.29 167.6 6.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.409 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 55.3 Cg_endo -69.8 -9.97 27.38 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.505 2.137 . . . . 0.0 112.657 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -30.04 46.23 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.02 32.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.144 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -92.74 177.0 6.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.043 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 5.3 m -89.3 173.42 8.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.0 OUTLIER -61.32 -41.73 97.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.934 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 57.9 m -60.82 -41.71 96.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.873 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.547 ' C ' HD13 ' A' ' 422' ' ' LEU . 3.5 tm? -60.43 -42.47 96.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.847 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 25.7 mt -59.86 -42.24 93.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 420' ' ' GLN . 28.0 t -62.37 -30.45 49.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.097 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . 0.401 ' OD1' ' CE2' ' A' ' 398' ' ' PHE . 1.9 m-80 -70.95 -44.88 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.535 HD11 HD11 ' A' ' 422' ' ' LEU . 28.7 mt -67.39 -44.25 79.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.894 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 11.3 mtt180 -59.88 -40.17 87.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -71.57 -34.62 70.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . 0.456 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 7.3 mtt -73.35 -33.84 65.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -66.15 -46.71 76.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -64.75 -38.37 90.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.738 ' HA ' HD12 ' A' ' 435' ' ' LEU . 56.8 t80 -71.17 -34.45 70.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.0 mt -75.53 -30.68 59.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -72.65 -27.4 62.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.738 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.8 mt -56.64 157.44 10.1 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.86 147.35 32.74 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.618 2.212 . . . . 0.0 112.331 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -63.98 -42.29 97.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.959 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.08 -31.66 70.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.65 -42.46 58.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -60.12 -45.19 93.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -62.23 -38.63 89.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.804 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -37.99 82.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.483 HD13 ' HE1' ' A' ' 432' ' ' PHE . 19.8 mt -73.65 -35.85 45.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.036 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.452 ' HE1' HG21 ' A' ' 396' ' ' VAL . 22.2 m-85 -67.14 -41.07 86.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.283 -179.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . 0.43 HG11 HD13 ' A' ' 426' ' ' LEU . 21.5 t . . . . . 0 N--CA 1.457 -0.105 0 CA-C-O 120.902 0.382 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.65 ' O ' HG22 ' A' ' 375' ' ' ILE . 39.7 m -100.02 173.65 6.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 21.5 t -58.63 -25.42 62.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -55.6 -24.74 34.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.138 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -57.46 -42.54 81.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.116 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.448 ' N ' HG23 ' A' ' 375' ' ' ILE . 87.6 m-85 -72.97 -47.48 45.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.905 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.95 -28.57 66.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.042 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 41.5 m0 -68.17 -56.27 9.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.924 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.421 HG22 HD11 ' A' ' 433' ' ' LEU . 22.3 t -58.65 -47.21 89.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -58.37 -38.72 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.66 -41.45 31.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.51 -40.2 95.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.894 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.24 -56.71 17.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.49 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -69.51 -33.01 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -86.51 -30.68 21.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 70.49 28.43 71.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.57 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 36.3 pt -106.87 164.32 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 151.86 36.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.984 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -60.78 -31.04 70.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.01 -40.21 94.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.8 t -73.65 -32.05 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.089 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -75.87 -51.26 12.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -59.62 -31.15 69.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.146 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -70.13 -43.09 71.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.932 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.01 -32.4 12.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.19 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.18 -65.8 0.76 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.193 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -135.78 106.63 6.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -70.28 95.14 0.98 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.87 -71.37 0.46 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.12 131.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.152 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.48 125.95 25.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.93 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.54 -27.69 6.8 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.507 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.506 HD23 HD11 ' A' ' 408' ' ' ILE . 5.3 tp -63.16 -33.17 74.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.861 0.362 . . . . 0.0 111.036 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 394' ' ' ALA . 3.4 tt -58.57 -43.3 89.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 59.8 p -67.3 -29.66 69.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.21 -44.25 38.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.506 HD11 HD23 ' A' ' 404' ' ' LEU . 12.7 mt -67.92 -33.55 61.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.156 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.5 mm? -76.95 -30.51 56.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.944 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 -67.62 -37.15 82.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -68.47 -50.9 48.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.96 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 61.24 31.58 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -95.68 129.92 42.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.834 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.89 165.6 9.62 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.622 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 57.2 Cg_endo -70.65 -8.97 24.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.614 2.209 . . . . 0.0 112.613 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -56.34 -40.66 74.82 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 t -110.74 -21.6 12.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.369 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -58.25 148.06 28.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.912 0.387 . . . . 0.0 111.109 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 33.9 m -76.89 -178.06 4.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.935 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.831 ' O ' HG23 ' A' ' 424' ' ' VAL . 9.2 tm0? -63.72 -30.45 71.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.923 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.9 m -57.4 -50.95 71.36 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.029 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 426' ' ' LEU . 0.7 OUTLIER -64.29 -40.19 95.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.689 ' HA ' HD12 ' A' ' 426' ' ' LEU . 96.3 mt -58.34 -31.99 68.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.0 t -74.07 -32.37 32.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.976 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -74.78 -40.96 60.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 423' ' ' LEU . 2.8 mt -65.68 -40.76 92.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -59.99 -41.17 91.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.814 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.91 94.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -38.83 73.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . 0.465 HE21 HD13 ' A' ' 375' ' ' ILE . 2.5 tt0 -60.9 -45.17 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.72 -39.58 80.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.878 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.58 ' HE1' HD13 ' A' ' 443' ' ' ILE . 86.5 t80 -70.41 -35.73 73.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.421 HD11 HG22 ' A' ' 379' ' ' VAL . 6.5 mt -81.3 -30.93 33.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -70.03 -29.13 66.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.903 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 17.7 mt -58.19 152.53 40.99 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.917 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.03 148.47 23.61 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.524 2.149 . . . . 0.0 112.32 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -60.97 -32.85 72.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.03 -38.08 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.047 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . 0.522 ' OE1' HD22 ' A' ' 435' ' ' LEU . 15.9 mt-10 -69.95 -40.2 75.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -60.15 -40.45 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -63.73 -37.23 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.01 -41.29 77.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.58 HD13 ' HE1' ' A' ' 432' ' ' PHE . 13.5 mt -69.43 -38.46 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.081 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -67.06 -33.57 75.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.936 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.549 ' O ' HG22 ' A' ' 375' ' ' ILE . 2.9 m -100.16 168.11 10.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -22.86 64.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 84.2 mt-10 -53.74 -26.61 24.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.211 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.695 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.2 tp -57.27 -44.84 84.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.196 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.492 ' N ' HG23 ' A' ' 375' ' ' ILE . 88.4 m-85 -73.22 -34.24 65.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -30.31 65.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.591 ' CB ' HD13 ' A' ' 433' ' ' LEU . 40.7 m0 -71.41 -37.8 71.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.979 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -64.72 -39.78 86.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.198 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 19.5 mtt-85 -67.97 -55.68 11.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -59.45 -30.66 68.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -78.83 -30.77 45.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.013 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 8.7 mt -68.5 -58.36 4.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -41.19 88.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.908 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -64.65 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.95 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.34 -52.32 65.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.067 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.36 69.29 1.36 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.413 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.493 HD13 ' CE1' ' A' ' 444' ' ' TYR . 33.9 pt -138.02 176.14 7.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 111.124 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 m -90.57 153.84 20.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.02 -30.94 69.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.88 90.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.093 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 396' ' ' VAL . 29.8 t -74.66 -35.32 37.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.176 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.629 ' CZ ' HG13 ' A' ' 379' ' ' VAL . 42.9 t80 -72.06 -25.97 61.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.091 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.42 -55.5 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.348 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -58.38 -46.93 85.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.059 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.687 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.3 m -63.22 -33.07 58.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -84.74 -70.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.454 ' CE2' ' HG2' ' A' ' 400' ' ' ARG . 2.0 p90 -143.05 112.85 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.94 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -58.62 124.77 20.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . 0.454 ' HG2' ' CE2' ' A' ' 398' ' ' PHE . 0.0 OUTLIER -170.1 -172.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.91 113.94 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.109 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.29 131.4 10.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.374 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.36 -14.36 10.93 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.784 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.0 tp -79.76 -43.03 23.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.746 0.307 . . . . 0.0 111.04 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.703 ' O ' HD23 ' A' ' 405' ' ' LEU . 9.2 tt -55.39 -28.38 53.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.21 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 24.9 p -70.95 -50.3 36.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.066 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.29 -41.38 94.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.592 HG23 HD11 ' A' ' 422' ' ' LEU . 28.4 mt -59.88 -44.62 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.019 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.552 HD12 ' CD2' ' A' ' 405' ' ' LEU . 7.4 mt -75.52 -30.61 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -47.6 65.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.895 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -66.89 -41.63 86.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 61.24 31.61 19.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.2 137.85 53.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -75.44 149.6 84.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.833 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.69 -5.74 17.56 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.552 2.168 . . . . 0.0 112.683 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -66.27 -57.59 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.774 0.321 . . . . 0.0 111.064 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 76.4 p -108.67 34.32 3.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.215 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 -177.26 3.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.3 174.61 8.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.979 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.655 ' O ' HG23 ' A' ' 424' ' ' VAL . 2.1 mt-30 -71.66 -31.73 67.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.592 HD11 HG23 ' A' ' 408' ' ' ILE . 5.0 tp -63.11 -39.23 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 420' ' ' GLN . 87.0 mt -59.94 -33.99 72.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 420' ' ' GLN . 29.1 t -73.91 -38.14 49.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.071 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -69.28 -50.14 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.938 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.553 HD22 HG21 ' A' ' 375' ' ' ILE . 75.0 mt -57.63 -32.01 66.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.981 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -63.8 -45.56 89.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.25 -43.28 74.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.137 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -35.33 75.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -69.74 -44.27 70.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -64.4 -35.3 80.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.933 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.77 -33.19 72.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 378' ' ' TRP . 11.7 mt -84.66 -30.46 24.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.876 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -70.85 -29.06 65.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.915 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.509 HD22 ' OE2' ' A' ' 439' ' ' GLU . 28.9 mt -57.79 158.72 11.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.31 165.47 30.35 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.639 2.226 . . . . 0.0 112.296 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.21 -33.14 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -34.95 74.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . 0.509 ' OE2' HD22 ' A' ' 435' ' ' LEU . 0.5 OUTLIER -74.74 -52.14 12.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.636 ' HA ' HD12 ' A' ' 443' ' ' ILE . 46.9 mtm180 -59.46 -30.54 68.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.996 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.71 -34.74 69.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.996 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -77.1 -31.55 56.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.636 HD12 ' HA ' ' A' ' 440' ' ' ARG . 7.0 mt -75.71 -40.51 40.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.053 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.493 ' CE1' HD13 ' A' ' 388' ' ' ILE . 13.0 m-85 -68.04 -29.48 68.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.07 -179.914 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.849 0.357 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.491 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -64.82 158.27 25.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.017 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.4 m -63.05 -21.41 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.11 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.6 mt-10 -53.03 -26.5 15.87 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.13 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.85 ' O ' HG23 ' A' ' 379' ' ' VAL . 6.5 tp -57.85 -42.62 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 111.132 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.584 ' CZ ' HD21 ' A' ' 426' ' ' LEU . 99.2 m-85 -70.47 -44.29 68.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -65.63 -31.34 72.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.947 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 45.6 m0 -70.57 -34.79 72.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.8 t -64.74 -37.73 80.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.031 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.8 -38.64 64.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.935 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -73.63 -34.67 65.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.949 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.9 -47.74 50.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.561 HD21 ' CB ' ' A' ' 393' ' ' PHE . 21.9 mt -59.87 -30.88 69.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -81.68 -39.16 24.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -72.81 -32.27 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -76.5 -67.72 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 106.54 58.68 0.6 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.467 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 31.8 pt -141.53 -179.71 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 0.0 111.072 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.41 154.81 17.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.786 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.839 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -58.78 -29.72 67.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.002 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.76 -47.35 86.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.161 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -51.64 49.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.15 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.561 ' CB ' HD21 ' A' ' 383' ' ' LEU . 51.6 t80 -58.41 -45.45 88.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.411 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -63.07 -30.08 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.185 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -51.38 12.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.943 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.51 -36.78 77.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.201 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -68.73 -58.34 4.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.425 ' CE1' HD12 ' A' ' 405' ' ' LEU . 20.3 p90 -150.81 111.05 4.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.097 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -75.22 119.65 19.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.59 -65.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.848 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . 0.762 HG23 ' HB2' ' A' ' 404' ' ' LEU . 2.6 t -161.46 146.7 13.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -80.08 147.85 31.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 77.1 3.79 82.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.79 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.762 ' HB2' HG23 ' A' ' 401' ' ' THR . 12.5 tp -88.31 -29.57 20.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.87 0.366 . . . . 0.0 110.93 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.0 tt -63.66 -20.9 66.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.164 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 85.3 p -68.42 -64.93 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.202 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -53.43 -40.07 64.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.242 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 422' ' ' LEU . 41.6 mt -59.88 -33.2 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.338 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.2 mt -91.23 -30.52 16.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.876 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 15.7 ttp85 -72.67 -40.21 66.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.22 -41.31 92.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.874 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 61.09 31.75 19.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.99 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -78.72 142.61 36.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -85.36 142.58 37.97 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.5 ' HB3' HD23 ' A' ' 423' ' ' LEU . 52.6 Cg_exo -52.4 -25.66 25.41 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.528 2.152 . . . . 0.0 112.43 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -57.43 -47.25 82.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.01 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.7 p -110.42 28.75 8.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.205 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.424 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.13 -178.71 3.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.125 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 74.7 m -99.94 172.48 7.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.778 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.9 mt-30 -62.25 -34.0 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.941 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.27 -46.03 85.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.734 HD11 HG23 ' A' ' 408' ' ' ILE . 7.3 tp -65.36 -40.67 93.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.909 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 420' ' ' GLN . 31.2 mt -59.65 -35.91 75.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.817 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.5 t -78.12 -37.19 22.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.853 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -60.69 -48.48 81.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.79 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.584 HD21 ' CZ ' ' A' ' 376' ' ' TYR . 3.6 mt -65.12 -37.48 87.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.761 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.93 -41.95 97.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.96 92.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.018 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.0 mtm -60.67 -34.22 74.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.798 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -64.43 -45.76 86.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.743 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.36 -48.81 80.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.852 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.46 ' HE1' HD13 ' A' ' 443' ' ' ILE . 54.3 t80 -60.63 -31.35 70.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.832 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.34 -28.61 26.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.941 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -69.94 -34.88 74.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.21 146.89 82.54 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.64 152.4 16.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.47 2.113 . . . . 0.0 112.329 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -31.1 69.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.11 93.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.018 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.16 -40.79 74.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.85 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 28.7 mtm-85 -61.87 -38.94 90.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.828 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -66.87 -38.72 86.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -35.41 78.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.863 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.46 HD13 ' HE1' ' A' ' 432' ' ' PHE . 7.5 mt -81.68 -35.37 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.09 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.21 -34.7 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.939 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.23 0.031 0 CA-C-O 120.848 0.356 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.599 ' O ' HG22 ' A' ' 375' ' ' ILE . 4.8 m -86.52 170.25 12.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.992 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -21.74 63.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.423 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 2.5 mp0 -52.15 -28.1 16.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.216 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.6 tp -58.81 -41.54 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.066 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.433 ' N ' HG23 ' A' ' 375' ' ' ILE . 92.0 m-85 -71.09 -36.44 72.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.827 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -69.31 -36.21 76.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.423 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.0 m0 -63.24 -40.48 97.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 375' ' ' ILE . 26.2 t -58.67 -52.58 58.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -60.08 -40.6 90.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.02 -36.51 80.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.02 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.17 -46.61 61.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.03 -35.22 74.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.88 -51.28 9.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.892 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -63.72 -52.24 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.931 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.5 8.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 94.64 59.06 1.15 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.476 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 33.7 pt -138.54 165.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.334 . . . . 0.0 111.089 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.75 157.95 31.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -30.69 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.929 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.93 -36.29 76.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.287 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.49 -52.53 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.141 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -57.02 -30.89 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.68 -29.36 29.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.104 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -73.6 -46.7 45.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.958 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.56 -38.1 75.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.17 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -69.15 -57.71 5.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -153.59 105.59 2.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.845 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -73.65 97.25 2.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 23.8 mtt85 -146.21 -65.35 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.831 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . 0.545 HG22 ' H ' ' A' ' 403' ' ' GLY . 26.3 m -154.16 117.65 4.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.075 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -60.88 -23.08 64.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.209 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . 0.545 ' H ' HG22 ' A' ' 401' ' ' THR . . . -91.17 17.45 55.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.875 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.481 ' HG ' HD11 ' A' ' 408' ' ' ILE . 10.0 tp -100.02 -37.85 8.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.317 . . . . 0.0 110.908 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 1.6 tp -57.92 -42.77 85.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.977 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 3.3 t -64.78 -29.51 70.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.031 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -80.15 -43.15 22.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.481 HD11 ' HG ' ' A' ' 404' ' ' LEU . 10.6 mt -67.97 -42.73 85.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.052 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 25.5 mt -66.57 -33.6 76.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.67 -38.31 73.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -65.9 -49.88 66.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.18 31.05 20.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.919 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.63 135.58 38.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -70.49 127.73 91.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.861 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.73 54.06 5.06 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.511 2.14 . . . . 0.0 112.478 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -100.03 -43.57 6.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.805 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.0 p -128.46 31.32 5.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.094 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.34 -178.31 6.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.3 p -77.27 175.05 10.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.856 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.7 mp0 -76.63 -31.44 57.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.932 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 3.2 t -59.46 -39.8 84.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.23 -40.8 64.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.72 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.845 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.856 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.4 t -60.43 -46.98 94.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.991 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -63.82 -46.42 85.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.76 -33.68 75.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.836 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -41.42 99.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.15 -49.73 76.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.994 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 6.4 ttm -66.13 -37.64 86.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -45.82 88.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -61.84 -36.74 82.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.747 ' HE1' HD13 ' A' ' 443' ' ' ILE . 17.1 t80 -68.91 -39.36 79.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.798 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.493 HD11 HG22 ' A' ' 379' ' ' VAL . 5.9 mt -78.21 -32.38 49.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -71.04 -30.71 66.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 432' ' ' PHE . 9.8 mt -58.92 159.5 13.34 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.4 147.83 90.73 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.549 2.166 . . . . 0.0 112.293 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.17 -29.98 67.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.15 -42.71 86.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.094 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.16 -42.42 65.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.483 ' HA ' HD12 ' A' ' 443' ' ' ILE . 41.6 mtm-85 -59.1 -42.22 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.68 -42.37 96.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.873 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -62.44 -50.05 73.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.747 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.6 mt -60.01 -42.62 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -65.65 -31.92 73.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.407 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 375' ' ' ILE . 13.0 m -99.62 169.38 9.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 79.6 p -63.5 -21.75 66.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.116 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 9.2 mm-40 -51.86 -27.16 11.76 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 111.211 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.712 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.1 tp -57.93 -44.88 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.167 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.592 ' OH ' HD21 ' A' ' 426' ' ' LEU . 93.1 m-85 -67.11 -43.6 82.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -67.61 -30.37 69.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.951 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 39.2 m0 -68.15 -42.05 80.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.948 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.3 t -59.53 -43.93 91.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.167 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -60.69 -57.19 13.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -46.36 89.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.29 -33.41 67.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.049 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.1 mt -71.14 -30.56 66.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.74 -35.0 24.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.53 -31.71 57.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.41 -44.95 15.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 73.92 63.98 2.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.447 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.497 HD11 ' HD2' ' A' ' 393' ' ' PHE . 41.4 pt -139.52 167.22 20.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.103 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 151.26 30.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.543 ' CG ' HD22 ' A' ' 405' ' ' LEU . 4.5 tt0 -60.29 -31.77 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.47 -39.5 91.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.131 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 24.8 t -75.86 -42.35 39.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.099 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.497 ' HD2' HD11 ' A' ' 388' ' ' ILE . 24.3 t80 -60.43 -50.46 73.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.64 -31.56 72.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -62.38 1.71 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -62.93 -37.06 78.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . 0.481 ' O ' ' HB1' ' A' ' 428' ' ' ALA . . . -67.64 -63.78 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.127 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.458 ' HE2' HD23 ' A' ' 404' ' ' LEU . 9.6 p90 -152.03 109.48 3.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.13 94.37 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.793 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -141.92 -70.11 0.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.793 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -157.41 165.14 36.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.02 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -88.65 -25.16 22.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.069 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -84.48 -26.03 40.78 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.628 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . 0.474 ' HG ' HD11 ' A' ' 408' ' ' ILE . 26.3 tp -58.59 -45.39 89.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.543 HD22 ' CG ' ' A' ' 390' ' ' GLN . 6.2 tt -60.08 -38.29 82.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.947 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 21.4 p -69.82 -31.1 68.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.936 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.26 -40.36 64.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 376' ' ' TYR . 11.4 mt -72.09 -47.59 53.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.06 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.35 -35.79 81.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.3 -42.37 65.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -48.78 80.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 60.27 32.93 20.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.97 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -91.07 126.6 36.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.922 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.66 151.36 71.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.7 46.49 2.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.769 2.313 . . . . 0.0 112.638 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -100.18 -34.06 10.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.748 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.4 31.15 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.42 -174.85 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . 0.483 ' O ' HD23 ' A' ' 423' ' ' LEU . 94.6 p -99.77 179.26 4.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.97 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.658 ' O ' HG23 ' A' ' 424' ' ' VAL . 49.9 tp60 -62.18 -52.27 64.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 2.7 t -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.936 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 422' ' ' LEU . 1.2 tm? -69.91 -33.9 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 419' ' ' SER . 4.2 mm? -77.69 -40.42 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.832 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -59.62 -48.98 85.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.142 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.54 -42.55 91.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.959 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.592 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.9 mp -65.05 -32.4 74.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.0 ttm105 -65.61 -40.72 92.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' A' ' 397' ' ' ALA . . . -59.82 -50.46 73.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.163 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 26.7 mtm -60.97 -34.27 74.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -70.53 -50.81 33.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.924 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.59 -35.1 75.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.529 ' HA ' HD12 ' A' ' 435' ' ' LEU . 42.0 t80 -74.33 -31.67 62.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 379' ' ' VAL . 21.3 mt -82.29 -31.32 30.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -79.23 -26.34 42.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 432' ' ' PHE . 8.9 mt -55.88 159.66 5.21 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.055 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -51.7 141.74 43.09 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.59 2.193 . . . . 0.0 112.435 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.75 -39.75 95.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.98 -32.38 73.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.49 -40.47 66.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.824 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 444' ' ' TYR . 87.5 mtm-85 -59.63 -41.05 89.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.47 -45.64 93.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -60.92 -41.8 96.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.45 -34.36 52.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.033 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 440' ' ' ARG . 10.9 m-85 -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.988 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.886 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.4 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.831 0.348 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.429 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -84.18 175.06 9.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.6 t -58.6 -21.57 53.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.202 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.7 mt-10 -52.55 -26.19 12.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.208 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.0 tp -56.98 -44.36 82.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.133 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.485 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.2 m-85 -69.72 -43.73 71.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -65.45 -31.51 72.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.606 ' HB3' HD13 ' A' ' 433' ' ' LEU . 36.0 m0 -65.49 -45.05 85.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -61.8 -38.67 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.103 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -67.83 -49.15 63.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -31.56 72.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.992 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -77.38 -31.3 54.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.986 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.89 -33.0 67.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.57 -34.39 35.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.872 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -78.53 -32.12 47.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -83.61 -56.75 3.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.94 52.47 2.24 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 4.0 pt -137.65 162.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.32 . . . . 0.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 19.7 m -74.53 150.46 39.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.686 ' HB3' HD22 ' A' ' 405' ' ' LEU . 79.1 mt-30 -60.19 -28.9 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.927 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.94 -46.4 85.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.223 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 28.8 t -69.92 -41.67 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.433 ' CE1' HG13 ' A' ' 379' ' ' VAL . 52.1 t80 -59.96 -36.58 77.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.015 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.7 -40.9 88.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -62.98 -51.8 65.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.19 -31.11 50.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.119 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.35 -76.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.566 ' HB3' ' HB3' ' A' ' 428' ' ' ALA . 7.2 p90 -126.93 117.99 23.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.71 95.5 6.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.788 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -145.18 -65.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.91 156.98 43.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.031 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -90.3 -32.85 16.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.06 26.79 19.27 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.522 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -99.98 -46.42 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.96 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.781 ' HA ' HD12 ' A' ' 408' ' ' ILE . 3.9 tt -57.89 -34.8 70.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.019 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.36 -30.88 67.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -79.42 -38.87 33.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.994 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -63.68 -51.05 75.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 405' ' ' LEU . 4.3 mm? -59.9 -38.96 83.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -37.39 83.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -63.63 -47.73 80.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 60.53 32.01 20.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.952 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.39 149.91 20.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.32 148.59 93.71 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.981 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.553 ' HB3' HD13 ' A' ' 426' ' ' LEU . 69.4 Cg_endo -74.42 -5.74 17.34 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.198 . . . . 0.0 112.602 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.61 -30.99 68.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.087 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.3 t -127.02 21.07 6.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.39 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.98 171.0 15.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . 0.415 ' O ' HD23 ' A' ' 423' ' ' LEU . 32.9 t -74.16 172.54 11.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.767 ' O ' HG23 ' A' ' 424' ' ' VAL . 16.2 pm0 -72.72 -30.42 64.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 52.1 p -67.94 -42.4 81.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.856 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 426' ' ' LEU . 1.1 tt -67.67 -40.75 84.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.507 ' HA ' HD12 ' A' ' 426' ' ' LEU . 2.7 mm? -57.77 -32.71 67.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.5 t -72.64 -35.4 50.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.984 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.77 -43.59 68.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.647 HD11 HD22 ' A' ' 422' ' ' LEU . 11.3 mt -60.07 -33.57 72.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -62.25 -56.29 20.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.566 ' HB3' ' HB3' ' A' ' 398' ' ' PHE . . . -62.86 -32.48 73.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.104 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 12.0 mtm -71.57 -36.57 70.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -66.74 -44.62 81.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.945 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -60.07 -46.01 90.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.609 ' HA ' HD12 ' A' ' 435' ' ' LEU . 20.8 t80 -58.14 -41.26 83.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.001 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.606 HD13 ' HB3' ' A' ' 378' ' ' TRP . 7.8 mt -71.49 -27.91 63.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.002 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -80.47 -25.03 39.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.166 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 432' ' ' PHE . 48.9 mt -55.36 154.14 12.28 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.014 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.34 145.59 35.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.568 2.179 . . . . 0.0 112.328 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -63.74 -35.04 79.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.66 -37.89 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -75.22 -42.0 56.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -59.27 -40.33 85.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.09 -42.74 96.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -47.56 80.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 31.3 mt -59.55 -34.43 54.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.949 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.02 -43.25 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.723 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.975 179.917 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.904 0.383 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.765 ' O ' HG22 ' A' ' 375' ' ' ILE . 31.2 m -100.01 -174.38 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.4 t -58.15 -23.44 55.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.092 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 5.2 mm-40 -55.52 -28.66 56.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.083 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.801 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.1 tp -59.19 -32.58 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.92 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.562 ' HE2' HG22 ' A' ' 408' ' ' ILE . 82.0 m-85 -77.86 -42.86 32.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.94 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -32.73 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.944 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.1 m0 -69.03 -44.92 71.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.012 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 375' ' ' ILE . 37.0 t -61.42 -40.86 87.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.06 -30.77 61.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -45.75 48.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.962 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.36 -35.93 82.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 383' ' ' LEU . 13.3 mt -67.54 -32.91 74.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -79.54 -44.24 21.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -33.97 75.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.32 -69.1 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.071 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.32 61.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.434 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 23.8 pt -137.5 164.67 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 0.0 111.116 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 p -72.32 152.43 42.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.435 ' HG2' HD22 ' A' ' 405' ' ' LEU . 6.2 mt-30 -62.42 -31.11 71.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.27 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.4 t -79.73 -40.9 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.566 ' CE2' HG13 ' A' ' 379' ' ' VAL . 48.1 t80 -68.21 -50.33 54.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.74 -37.55 82.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 22.2 ttt-85 -60.63 -41.22 94.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.832 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.406 ' HB ' ' CE1' ' A' ' 432' ' ' PHE . 26.9 m -85.89 -30.4 6.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.84 -65.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . 0.495 ' CE1' HD12 ' A' ' 405' ' ' LEU . 3.8 p90 -143.47 102.62 3.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -68.61 97.49 0.8 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.829 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -142.07 -70.67 0.34 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.32 143.53 16.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.061 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -77.64 125.78 29.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.974 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 112.05 -28.47 9.26 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.428 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.03 -31.4 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.763 ' HA ' HD12 ' A' ' 408' ' ' ILE . 5.8 tt -59.21 -47.47 85.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -31.41 72.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.903 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -68.45 -39.57 81.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.988 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.6 mt -64.96 -35.7 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.031 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.62 -35.16 45.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.925 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -71.33 -42.89 67.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 60.29 34.3 20.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.975 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.38 142.83 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.11 149.71 89.67 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.99 -11.37 29.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.571 2.18 . . . . 0.0 112.585 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -68.62 -38.89 80.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.361 . . . . 0.0 110.966 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -99.78 -26.87 13.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -55.58 176.38 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.243 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 43.4 t -82.76 175.93 9.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.669 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -70.7 -31.05 67.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.856 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 m -58.84 -46.6 87.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.828 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.709 HD11 HG23 ' A' ' 408' ' ' ILE . 11.5 tp -65.03 -38.91 92.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 420' ' ' GLN . 2.6 mt -59.83 -31.2 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.815 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.6 t -74.11 -47.38 42.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.065 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -63.75 -42.46 97.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.13 -35.16 74.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -63.51 -39.15 93.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.03 89.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.54 -36.84 79.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -66.34 -46.94 75.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -60.63 -52.94 62.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.64 ' HE1' HD13 ' A' ' 443' ' ' ILE . 66.6 t80 -57.46 -40.62 78.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.987 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.32 -26.42 61.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -72.82 -28.2 62.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.87 149.24 55.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.924 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.7 161.49 4.4 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.602 2.201 . . . . 0.0 112.34 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.39 -31.51 72.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.08 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -71.01 -42.83 69.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.409 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 78.1 mtm-85 -64.56 -42.87 95.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.07 -34.44 78.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -67.35 -47.4 70.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.837 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.64 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.4 mt -63.57 -47.26 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 21.2 m-85 -60.77 -34.2 74.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.862 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.311 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.871 0.367 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.5 m -97.07 177.51 5.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.951 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 39.7 t -66.2 -15.47 63.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.17 -29.35 21.88 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.082 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.5 tp -59.87 -40.18 82.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.432 ' CD1' HG23 ' A' ' 375' ' ' ILE . 86.5 m-85 -70.97 -38.3 72.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -71.49 -31.35 67.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.432 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 44.2 m0 -65.48 -44.44 87.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.791 HG13 ' CE1' ' A' ' 393' ' ' PHE . 22.0 t -68.64 -43.11 83.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.074 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 34.5 mtt180 -60.38 -44.62 95.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.87 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -69.46 -37.23 77.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -43.68 94.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 59.4 mt -60.41 -38.2 83.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.833 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -78.36 -31.82 48.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 11.5 mtt-85 -64.87 -65.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -74.12 -30.87 62.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.181 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 76.52 45.82 13.13 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.522 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 27.7 pt -108.11 165.07 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.82 0.343 . . . . 0.0 111.179 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 43.8 m -81.67 154.03 26.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.515 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.0 mt-30 -60.39 -29.2 68.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.995 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.97 -45.09 87.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.504 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.2 t -70.66 -49.9 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.791 ' CE1' HG13 ' A' ' 379' ' ' VAL . 37.5 t80 -61.87 -41.02 97.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.9 70.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.161 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -48.18 16.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.924 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.7 m -73.79 -29.1 25.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.225 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.78 -60.96 2.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.131 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -146.89 105.88 3.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -74.29 100.67 3.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.35 -69.38 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.2 p -153.03 134.04 14.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.156 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.47 139.75 45.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 99.35 -24.59 31.6 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.581 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.6 tp -62.75 -36.16 82.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.515 HD22 ' HG2' ' A' ' 390' ' ' GLN . 9.1 tt -58.56 -46.85 86.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.028 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -28.85 66.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.965 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -78.71 -41.68 30.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 422' ' ' LEU . 19.3 mt -65.7 -38.9 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 409' ' ' LEU . 13.5 mt -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.982 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -69.45 -31.42 69.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 20.3 mttp -85.2 -45.84 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 61.28 31.95 19.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.814 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.24 169.96 9.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.08 130.37 26.31 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.832 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.639 ' HG3' HD13 ' A' ' 426' ' ' LEU . 52.2 Cg_exo -52.66 -25.92 27.9 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.465 2.11 . . . . 0.0 112.364 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -58.13 -33.75 69.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.999 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 8.9 t -111.32 -19.82 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.353 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -53.78 173.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.9 0.381 . . . . 0.0 111.311 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 53.0 m -81.25 -179.78 7.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.751 ' HA ' HD12 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -72.74 -36.93 67.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.846 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -46.23 88.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.879 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.745 HD11 HG23 ' A' ' 408' ' ' ILE . 3.2 tp -61.83 -39.9 93.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.751 HD12 ' HA ' ' A' ' 420' ' ' GLN . 13.2 mt -59.07 -32.88 70.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.738 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 420' ' ' GLN . 22.2 t -77.67 -34.91 20.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.04 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -72.37 -47.32 50.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.639 HD13 ' HG3' ' A' ' 415' ' ' PRO . 25.1 mt -61.57 -34.89 76.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.785 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.3 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.79 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.49 87.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.989 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.1 mtp -64.79 -35.67 81.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.808 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -62.86 -45.9 90.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.763 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -61.95 -42.96 99.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.812 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.476 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.1 t80 -63.03 -44.05 97.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.77 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.42 HD13 ' HB3' ' A' ' 378' ' ' TRP . 22.6 mt -71.58 -25.82 62.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.041 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -69.88 -29.38 66.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.95 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 60.3 mt -58.94 154.81 36.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.968 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.27 162.87 38.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.624 2.216 . . . . 0.0 112.275 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -59.63 -37.21 78.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.74 -38.93 92.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.08 -41.77 58.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.488 ' HA ' HD12 ' A' ' 443' ' ' ILE . 66.8 mtm180 -59.81 -45.82 91.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -62.44 -39.06 92.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -62.81 -35.55 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 440' ' ' ARG . 8.7 mt -76.48 -34.12 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.06 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -66.16 -54.07 29.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.955 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . 0.648 HG11 HD23 ' A' ' 426' ' ' LEU . 21.8 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.803 0.335 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.787 ' O ' HG22 ' A' ' 375' ' ' ILE . 0.9 OUTLIER -100.04 -175.22 2.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -23.95 63.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.119 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.02 -28.55 62.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.787 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -58.01 -35.73 53.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.146 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -76.65 -40.36 49.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.864 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -69.46 -30.97 68.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.794 ' HB3' HD13 ' A' ' 433' ' ' LEU . 49.9 m0 -67.79 -43.07 80.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.952 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -58.82 -44.55 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.129 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -72.18 -49.11 38.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.975 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.9 -30.53 69.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.992 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -80.91 -38.49 27.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.995 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 HG13 ' A' ' 388' ' ' ILE . 7.1 mt -64.95 -40.41 94.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.969 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 -32.14 65.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.995 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.51 -31.35 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.06 -52.82 6.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 88.15 72.09 1.28 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.502 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.54 HD13 ' CE1' ' A' ' 444' ' ' TYR . 21.4 pt -148.77 173.59 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 111.158 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 3.2 m -90.41 152.6 20.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.5 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.57 -30.82 70.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.862 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.64 98.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.127 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.587 ' O ' HG22 ' A' ' 396' ' ' VAL . 32.8 t -70.61 -48.21 59.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.161 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -58.28 -48.65 79.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.416 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -60.53 -30.71 69.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -76.0 -55.28 5.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.867 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 392' ' ' VAL . 23.9 m -67.04 -27.91 41.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.211 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -77.4 -73.85 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -128.92 113.08 14.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -78.8 90.54 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . 0.621 ' O ' HG23 ' A' ' 401' ' ' THR . 7.4 tpt180 -132.77 -66.19 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . 0.621 HG23 ' O ' ' A' ' 400' ' ' ARG . 1.0 OUTLIER -163.84 155.67 16.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 8.3 tm0? -85.19 137.69 32.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.7 -27.57 17.2 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.78 -31.49 69.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 110.932 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.613 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.7 tt -60.44 -48.46 81.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 9.5 m -61.54 -38.66 88.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -40.68 90.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.002 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.4 mt -67.7 -37.28 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.118 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 91.9 mt -79.22 -27.69 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.998 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.68 -31.01 64.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -69.05 -42.81 75.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 61.25 27.59 17.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.979 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.0 161.6 13.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.864 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.0 142.78 25.26 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.979 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 49.9 Cg_exo -54.85 -19.86 20.6 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.38 2.053 . . . . 0.0 112.584 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -49.17 -27.98 4.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.327 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 p -125.02 20.95 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.453 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -100.19 -173.02 2.32 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.05 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.05 178.66 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.752 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 423' ' ' LEU . 1.1 tp-100 -70.03 -31.03 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 22.6 t -58.94 -49.94 75.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 18.2 tp -62.08 -38.32 88.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 420' ' ' GLN . 50.0 mt -59.63 -30.81 68.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.815 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -71.98 -50.12 39.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.204 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -60.55 -44.04 96.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.648 HD23 HG11 ' A' ' 371' ' ' VAL . 7.9 mp -65.68 -31.54 72.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.22 -51.37 69.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.16 70.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -44.29 78.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . 0.429 ' HB2' HD13 ' A' ' 375' ' ' ILE . 8.5 tt0 -64.08 -44.96 90.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -60.36 -40.83 92.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.54 ' HA ' HD12 ' A' ' 435' ' ' LEU . 44.2 t80 -66.09 -33.6 76.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.785 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.794 HD13 ' HB3' ' A' ' 378' ' ' TRP . 13.4 mt -83.74 -27.74 28.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.998 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -74.9 -28.18 60.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.984 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.0 OUTLIER -56.92 161.89 4.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . 0.516 ' HD2' HD23 ' A' ' 435' ' ' LEU . 41.5 Cg_endo -67.33 148.39 79.74 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.513 2.142 . . . . 0.0 112.32 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.46 -31.29 69.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.963 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -46.07 90.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -45.16 68.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.961 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -58.19 -36.86 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.29 -37.58 87.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.811 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -75.0 -34.59 61.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.823 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 443' ' ' ILE . 9.8 mt -75.75 -10.88 13.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.459 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.54 ' CE1' HD13 ' A' ' 388' ' ' ILE . 4.8 m-85 -95.76 -29.63 14.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.436 -179.82 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.841 0.353 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 375' ' ' ILE . 5.0 m -99.8 163.1 12.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.2 t -66.31 -20.88 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.6 -27.53 11.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 111.199 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.7 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.9 tp -58.02 -44.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.109 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.591 ' HE1' HG22 ' A' ' 408' ' ' ILE . 76.9 m-85 -66.85 -40.83 88.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -66.91 -32.35 73.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.413 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.6 m0 -69.07 -46.75 67.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.933 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -60.53 -33.3 53.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.028 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -74.13 -43.55 57.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.813 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.21 -35.55 71.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.833 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.77 -36.49 78.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.891 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -35.83 79.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.851 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -72.46 -38.85 68.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -43.95 57.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.828 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.73 -32.02 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 64.54 30.81 78.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.512 HD13 ' CE1' ' A' ' 444' ' ' TYR . 42.6 pt -102.45 162.19 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.745 0.307 . . . . 0.0 111.154 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.42 151.78 42.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.57 ' HB3' HD22 ' A' ' 405' ' ' LEU . 52.8 mt-30 -62.76 -31.67 72.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.09 96.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.02 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -70.9 -43.12 77.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -61.99 -44.78 96.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.5 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -65.33 -30.56 71.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.138 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -72.86 -35.33 67.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -87.99 -31.48 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . 0.421 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -78.53 -63.03 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.086 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -140.12 98.42 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 97.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.919 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -136.37 -67.0 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 66.8 p -156.37 147.38 22.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.092 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.9 136.85 38.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 98.26 -27.42 19.43 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 9.8 tp -59.4 -36.03 75.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 409' ' ' LEU . 10.0 tt -59.88 -31.07 69.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.959 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 54.3 m -74.99 -44.92 45.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.98 -41.04 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.591 HG22 ' HE1' ' A' ' 376' ' ' TYR . 13.6 mt -69.38 -32.27 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.008 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.8 mm? -81.55 -30.67 33.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -44.1 61.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -45.52 91.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.952 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.99 31.3 19.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.34 151.72 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.05 146.57 63.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.94 -27.31 14.41 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.524 2.15 . . . . 0.0 112.405 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -58.39 -33.06 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.975 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 24.9 p -114.88 27.24 9.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.207 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.06 -169.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 18.5 m -99.59 173.13 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.884 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.6 mm100 -62.79 -47.58 82.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 6.3 p -59.31 -39.82 84.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.738 HD13 ' O ' ' A' ' 422' ' ' LEU . 3.2 tm? -68.82 -34.58 75.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.887 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.66 -35.43 67.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 420' ' ' GLN . 24.1 t -65.69 -47.41 86.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.028 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -65.54 -37.65 87.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.93 -35.28 78.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.37 -44.9 95.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.12 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.043 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . 0.421 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 2.6 mtm -64.78 -36.37 84.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.863 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . 0.455 ' HG3' HD13 ' A' ' 375' ' ' ILE . 15.2 tt0 -67.95 -42.87 80.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.28 -40.95 97.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.468 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.9 t80 -62.97 -35.7 81.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.845 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 378' ' ' TRP . 11.3 mt -79.49 -26.63 41.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.934 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -70.0 -28.28 65.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.928 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.423 HD13 ' OE1' ' A' ' 439' ' ' GLU . 80.0 mt -57.98 155.3 24.67 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.97 163.5 35.46 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.559 2.173 . . . . 0.0 112.286 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -59.58 -31.47 69.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.52 75.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.192 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . 0.423 ' OE1' HD13 ' A' ' 435' ' ' LEU . 4.5 mm-40 -75.35 -51.61 12.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.406 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 6.2 mtp180 -58.76 -38.64 78.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.905 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.1 -47.99 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.951 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -39.8 77.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.033 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.468 HD13 ' HE1' ' A' ' 432' ' ' PHE . 18.0 mt -73.07 -45.36 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.14 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.512 ' CE1' HD13 ' A' ' 388' ' ' ILE . 16.2 m-85 -62.96 -49.95 72.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.951 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . 0.501 HG22 ' NE2' ' A' ' 430' ' ' GLN . 7.9 t . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.701 0.286 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.596 ' O ' HG22 ' A' ' 375' ' ' ILE . 67.5 m -62.78 -177.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.003 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.4 m -66.93 -22.35 65.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.054 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . 0.435 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 36.5 mt-10 -51.02 -27.39 7.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.175 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.639 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.4 tp -59.58 -44.89 94.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.575 ' HE1' HG22 ' A' ' 408' ' ' ILE . 88.5 m-85 -65.74 -36.87 84.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.04 -31.01 68.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.435 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.1 m0 -72.05 -45.91 58.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . 0.779 HG22 HD11 ' A' ' 433' ' ' LEU . 30.4 t -60.47 -33.57 54.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.033 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -69.3 -41.25 77.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -37.0 50.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.951 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -61.21 -39.14 89.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.963 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 26.8 mt -74.14 -32.2 63.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.21 -31.56 62.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.967 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 16.0 mmt85 -77.96 -62.2 1.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.35 84.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.111 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 69.82 64.39 2.94 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.448 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.452 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 25.2 pt -131.56 157.28 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.759 0.314 . . . . 0.0 111.181 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . 0.666 ' OG ' HG23 ' A' ' 392' ' ' VAL . 4.9 p -65.0 157.07 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . 0.551 ' NE2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -68.13 -34.55 76.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.872 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.71 -30.88 69.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.108 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.666 HG23 ' OG ' ' A' ' 389' ' ' SER . 30.0 t -77.1 -50.66 20.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . 0.414 ' HA ' HG22 ' A' ' 396' ' ' VAL . 16.2 t80 -64.68 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.65 -41.79 87.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.167 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -47.65 70.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.847 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 392' ' ' VAL . 35.7 m -69.43 -37.89 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.186 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -72.27 -70.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -134.49 113.28 11.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.857 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -60.34 96.54 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.86 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -147.79 178.82 8.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.759 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.01 151.0 46.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -67.95 149.24 50.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.946 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.29 -27.72 15.92 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.542 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.87 -34.09 74.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.834 0.35 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 408' ' ' ILE . 4.3 tt -59.76 -50.44 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.8 p -60.27 -30.64 69.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -71.49 -33.22 69.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.957 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.9 mt -77.2 -36.25 24.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.489 HD23 HD23 ' A' ' 405' ' ' LEU . 4.0 mm? -74.09 -35.18 64.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -55.66 5.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -60.07 -48.41 81.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.878 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 60.13 30.96 20.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.989 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.8 115.68 6.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.49 149.17 84.64 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.429 ' HG3' ' HB ' ' A' ' 371' ' ' VAL . 94.1 Cg_endo -83.49 47.36 2.33 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.844 2.363 . . . . 0.0 112.823 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -100.15 -50.87 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 0.0 110.91 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.11 30.7 6.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -90.84 -177.48 4.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.087 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . 0.6 ' O ' HD23 ' A' ' 423' ' ' LEU . 0.3 OUTLIER -87.5 178.58 6.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 179.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.893 ' O ' HG23 ' A' ' 424' ' ' VAL . 74.3 mt-30 -75.14 -30.22 60.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.964 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -50.5 73.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.089 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 56.0 tp -64.72 -41.43 95.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 419' ' ' SER . 3.7 mm? -58.65 -38.87 79.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 420' ' ' GLN . 32.2 t -67.52 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -42.33 54.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.786 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.18 -42.3 99.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.795 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -60.53 -40.92 93.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.29 99.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.063 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.9 mtm -70.14 -34.93 73.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.822 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . 0.501 ' NE2' HG22 ' A' ' 371' ' ' VAL . 25.3 tt0 -69.02 -47.09 66.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.715 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -59.64 -37.59 79.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.503 ' HA ' HD12 ' A' ' 435' ' ' LEU . 3.5 t80 -67.88 -44.55 76.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . 0.779 HD11 HG22 ' A' ' 379' ' ' VAL . 18.2 mt -72.49 -33.22 66.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.811 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -69.89 -31.61 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.786 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 432' ' ' PHE . 14.3 mt -59.15 159.86 13.6 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.49 148.29 87.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.464 2.109 . . . . 0.0 112.32 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.7 -30.03 67.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.994 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -57.82 -40.48 80.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.119 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -51.81 23.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.448 ' HA ' HD12 ' A' ' 443' ' ' ILE . 86.7 mtm-85 -59.72 -30.79 69.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -55.54 31.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.932 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.76 -43.99 97.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.976 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.481 HD13 ' HE1' ' A' ' 432' ' ' PHE . 24.4 mt -58.93 -30.68 43.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.048 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.452 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 15.0 m-85 -87.47 -38.25 16.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.832 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 -179.923 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 30.8 t . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.849 0.357 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 375' ' ' ILE . 1.6 m -95.1 -176.69 3.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.951 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 66.4 m -66.61 -20.92 66.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.222 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -51.74 -29.62 19.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.877 0.37 . . . . 0.0 111.167 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 372' ' ' SER . 1.0 OUTLIER -59.43 -44.23 92.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.11 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 376' ' ' TYR . . . . . 0.476 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.9 m-85 -62.93 -48.77 77.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -32.25 68.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.754 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 54.4 m0 -64.1 -48.62 75.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.086 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 23.2 t -57.27 -42.12 79.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.353 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -60.58 -44.19 96.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -73.4 -41.84 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -42.37 95.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.048 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 383' ' ' LEU . 15.0 mt -60.32 -49.47 77.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.861 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -70.03 -37.89 75.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -67.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.04 -45.34 93.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.191 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 84.92 72.88 1.28 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.429 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 388' ' ' ILE . . . . . 0.421 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 19.5 pt -148.41 156.17 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.833 0.349 . . . . 0.0 111.127 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.01 152.96 42.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.895 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.34 -30.07 69.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.868 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -58.52 -38.19 77.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.144 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 392' ' ' VAL . . . . . 0.626 ' O ' HG22 ' A' ' 396' ' ' VAL . 30.2 t -77.9 -50.51 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.006 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -58.2 -35.02 71.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.014 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.76 61.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.087 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -31.26 41.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.8 m -89.0 -27.9 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.181 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -76.58 -61.6 1.91 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -146.13 119.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.894 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -76.45 101.4 5.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.29 -65.9 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.65 155.78 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.054 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.09 -32.98 39.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.945 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.29 27.16 18.14 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.56 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 13.6 tp -100.09 -38.17 8.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 405' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 409' ' ' LEU . 2.1 tt -59.47 -33.71 71.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 30.8 t -76.73 -31.58 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.889 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.4 -35.61 75.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 408' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 405' ' ' LEU . 9.9 mt -69.85 -40.49 78.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 409' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 405' ' ' LEU . 4.7 mt -75.98 -31.01 58.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.898 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -71.01 -37.9 72.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.35 -39.48 78.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 61.06 29.73 19.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 136.62 32.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.21 147.23 37.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 415' ' ' PRO . . . . . 0.561 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 51.3 Cg_exo -52.86 -23.48 21.05 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.415 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -54.64 -29.78 53.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.065 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -130.86 19.75 5.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.297 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -91.13 163.64 14.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.196 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 3.1 p -80.02 -178.12 6.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.84 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 420' ' ' GLN . . . . . 0.459 ' O ' HG23 ' A' ' 424' ' ' VAL . 6.5 tt0 -69.42 -43.89 72.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 15.8 m -58.51 -34.15 70.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 422' ' ' LEU . . . . . 0.696 HD13 ' O ' ' A' ' 422' ' ' LEU . 2.9 tm? -71.88 -38.13 70.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 35.8 mt -64.68 -40.4 95.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 424' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 420' ' ' GLN . 42.3 t -66.38 -46.12 87.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.05 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -60.52 -41.5 94.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.48 -33.82 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.975 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -60.86 -44.47 96.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.82 76.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.0 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.5 ttm -68.05 -43.09 79.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -60.68 -47.97 83.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 432' ' ' PHE . . . . . 0.545 ' HA ' HD12 ' A' ' 435' ' ' LEU . 22.9 t80 -61.43 -41.6 97.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 42.1 mt -73.71 -28.38 61.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.022 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -69.97 -38.85 76.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 5.9 mt -60.7 145.27 88.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.059 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.12 164.72 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.574 2.183 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.72 -33.41 75.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.48 81.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.021 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -50.5 41.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.715 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 88.2 mtm-85 -57.75 -36.02 71.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.784 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -54.16 49.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.09 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 10.0 mtp-105 -58.86 -47.87 83.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' ILE . . . . . 0.523 HD12 ' HE1' ' A' ' 432' ' ' PHE . 56.0 mt -60.27 -28.74 42.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 444' ' ' TYR . . . . . 0.421 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.9 m-85 -72.91 -44.21 61.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.476 -179.954 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.831 0.348 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.1 m -145.97 30.99 1.04 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.16 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.03 176.89 4.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . 0.473 HG12 ' HG2' ' A' ' 415' ' ' PRO . 21.5 t -78.94 101.63 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.098 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 5.1 m -100.02 179.39 4.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.9 -19.37 65.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.199 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.0 mt-10 -51.7 -27.13 10.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.202 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.568 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.3 tp -57.7 -43.65 84.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.998 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.469 ' N ' HG23 ' A' ' 375' ' ' ILE . 96.6 m-85 -72.06 -38.16 69.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.785 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -32.95 73.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.427 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.7 m0 -65.07 -43.91 90.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -58.53 -41.11 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.62 -37.21 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.56 -39.44 62.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.72 -36.68 81.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.07 -37.42 72.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -78.12 -31.4 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -53.46 7.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.931 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -67.39 -47.08 71.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 82.55 61.03 2.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.506 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.629 HD13 ' CE1' ' A' ' 444' ' ' TYR . 22.8 pt -134.46 166.2 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.813 0.339 . . . . 0.0 111.153 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.46 157.31 34.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -64.1 -31.45 72.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . 0.413 ' HB2' ' OE1' ' A' ' 402' ' ' GLN . . . -60.63 -35.95 77.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.076 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 396' ' ' VAL . 23.3 t -75.33 -56.56 8.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.068 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.421 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -59.1 -30.53 68.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -76.75 -29.93 56.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.268 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -81.55 -31.07 32.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.985 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.8 m -88.47 -27.15 5.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.274 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -80.35 -52.43 7.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.072 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.454 ' HE1' HD12 ' A' ' 405' ' ' LEU . 3.0 p90 -154.92 89.26 1.22 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.886 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.55 120.34 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 401' ' ' THR . 0.3 OUTLIER -161.91 -72.14 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.819 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.3 OUTLIER -164.29 129.97 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.051 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 391' ' ' ALA . 0.5 OUTLIER -63.46 151.43 41.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.822 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.46 -28.01 14.98 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.458 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.468 ' HG ' HD11 ' A' ' 408' ' ' ILE . 12.7 tp -66.52 -39.81 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.861 0.362 . . . . 0.0 110.939 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.521 HD21 HD12 ' A' ' 409' ' ' LEU . 7.4 tt -58.74 -29.48 66.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.029 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.9 t -68.93 -43.0 75.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -69.74 -37.46 76.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.654 HG23 HD21 ' A' ' 422' ' ' LEU . 16.4 mt -69.37 -34.08 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.232 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.521 HD12 HD21 ' A' ' 405' ' ' LEU . 3.4 mt -81.59 -31.81 32.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -66.31 -48.65 69.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.835 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -67.87 -47.58 68.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.95 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 61.21 30.0 19.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.6 136.39 55.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -74.22 144.35 81.52 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.473 ' HG2' HG12 ' A' ' 371' ' ' VAL . 52.7 Cg_exo -52.66 -27.35 33.04 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.565 2.177 . . . . 0.0 112.231 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -38.14 77.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.974 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 m -120.73 30.55 6.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 167.41 10.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 37.5 m -85.38 175.02 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.857 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.531 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.9 mt-30 -62.74 -51.28 67.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.86 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 4.0 t -59.3 -30.82 68.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.654 HD21 HG23 ' A' ' 408' ' ' ILE . 2.7 tm? -71.42 -44.18 65.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.17 -36.99 76.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.945 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -69.5 -33.07 55.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.241 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.54 -48.16 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 422' ' ' LEU . 16.1 mt -68.24 -32.74 73.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -43.64 97.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.956 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -70.85 -40.22 72.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.143 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 7.4 mtt -63.42 -31.4 72.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.939 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -70.23 -46.66 64.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -60.19 -35.91 76.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.37 -38.13 77.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.93 -31.69 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -72.75 -29.6 63.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.35 159.87 10.78 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.89 151.76 73.79 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.626 2.217 . . . . 0.0 112.311 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.06 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.79 -38.77 79.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.46 -48.13 51.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 42.3 mtm180 -59.48 -34.07 72.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.932 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -64.57 -41.14 96.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.6 -33.6 74.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.87 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 20.4 mt -77.51 -40.63 28.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.068 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.629 ' CE1' HD13 ' A' ' 388' ' ' ILE . 9.5 m-85 -66.19 -35.34 80.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.962 0.41 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -74.35 -61.36 1.89 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.878 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.23 104.46 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.942 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -131.14 -46.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -91.03 64.65 5.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.881 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.34 -40.67 87.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.905 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.63 52.7 2.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.878 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.51 106.01 0.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.571 ' H ' HD23 ' A' ' 452' ' ' LEU . 0.5 OUTLIER -70.46 171.0 10.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.832 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -123.48 147.36 47.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.849 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -89.93 117.56 28.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.158 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.126 179.911 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -151.1 -52.83 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.224 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -128.32 121.73 29.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.28 116.82 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.135 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.697 ' O ' HG22 ' A' ' 375' ' ' ILE . 64.3 m -86.29 173.01 10.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.935 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 55.0 m -62.18 -24.11 67.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.123 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -53.28 -27.65 23.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.781 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.9 tp -57.99 -37.49 61.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.051 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.443 ' OH ' HD21 ' A' ' 426' ' ' LEU . 88.8 m-85 -75.69 -42.69 50.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.887 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.85 -31.15 72.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.927 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.403 ' HB3' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -71.01 -44.28 66.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.986 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 375' ' ' ILE . 29.5 t -59.48 -33.87 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -76.46 -45.52 30.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -67.4 -40.24 85.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.004 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -31.69 70.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.982 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.4 mt -71.11 -32.03 68.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.979 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.36 -31.18 17.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.919 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -80.13 -32.9 38.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -80.32 -53.29 6.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.102 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 93.64 59.32 1.21 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.511 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.447 HD13 ' CE1' ' A' ' 444' ' ' TYR . 16.7 pt -140.34 179.23 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.918 0.389 . . . . 0.0 111.067 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.09 149.76 21.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.99 -29.6 65.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.051 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.4 -49.0 79.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.873 ' O ' HG22 ' A' ' 396' ' ' VAL . 25.3 t -66.28 -50.53 67.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.127 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.526 ' CE1' HG13 ' A' ' 379' ' ' VAL . 14.0 t80 -57.78 -30.98 66.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.019 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.47 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -82.77 -30.28 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.72 -31.24 36.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.91 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.873 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.6 m -86.05 -30.03 6.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.198 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.25 -43.14 24.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.086 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.443 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 14.3 p90 -166.98 111.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.74 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.53 124.82 20.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . 0.409 ' N ' ' HD3' ' A' ' 400' ' ' ARG . 0.0 OUTLIER -160.74 -177.42 6.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.954 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -84.2 144.38 29.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.029 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.5 139.27 55.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 105.11 -27.61 17.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.502 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.422 ' HG ' HD11 ' A' ' 408' ' ' ILE . 4.8 tp -64.08 -55.88 18.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 408' ' ' ILE . 0.5 OUTLIER -59.02 -32.81 70.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.966 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.18 -30.49 68.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.851 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -39.22 21.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.843 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 405' ' ' LEU . 10.1 mt -65.61 -34.58 71.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 8.4 mt -78.74 -31.47 46.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.786 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -72.5 -44.29 62.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -60.23 -49.39 77.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.856 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.44 31.23 20.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.906 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -85.12 151.12 24.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.91 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.52 144.14 80.31 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.13 -4.32 15.21 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.529 2.153 . . . . 0.0 112.673 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -56.86 -46.39 81.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.747 0.308 . . . . 0.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.3 p -109.29 31.67 5.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.167 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.79 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -99.99 164.55 11.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.18 174.19 11.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.834 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.664 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -64.8 -39.35 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.2 p -58.73 -41.02 85.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.79 HD23 ' CB ' ' A' ' 418' ' ' ALA . 19.8 tp -69.04 -31.24 69.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.879 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.21 -44.51 65.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.8 t -59.7 -43.73 92.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -67.98 -44.72 76.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.443 HD21 ' OH ' ' A' ' 376' ' ' TYR . 6.8 mp -67.1 -39.84 86.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.946 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -60.44 -41.1 93.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.867 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.37 -39.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.102 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.36 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.43 -38.04 71.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.809 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.53 -42.91 95.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.563 ' HA ' HD12 ' A' ' 435' ' ' LEU . 24.3 t80 -62.37 -46.42 88.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 378' ' ' TRP . 34.0 mt -65.53 -29.74 70.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.01 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -70.06 -29.62 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.936 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 432' ' ' PHE . 35.9 mt -58.49 147.9 67.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.86 158.76 5.91 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.576 2.184 . . . . 0.0 112.224 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.53 -31.46 72.68 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.894 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -68.28 -35.1 77.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -75.44 -39.57 58.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.906 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -59.75 -42.17 92.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.53 81.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -42.04 90.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.87 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 29.6 mt -74.76 -29.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.203 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.447 ' CE1' HD13 ' A' ' 388' ' ' ILE . 5.9 m-85 -69.51 -46.59 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.887 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.83 -42.7 48.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.959 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.91 127.23 34.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . 0.763 ' OE2' HG13 ' A' ' 392' ' ' VAL . 2.3 mt-10 -152.31 -46.87 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.875 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -97.1 -28.59 14.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.016 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.96 -0.33 38.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.556 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.95 -29.28 67.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.759 0.314 . . . . 0.0 110.909 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 83.3 p -59.0 114.46 2.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.894 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 452' ' ' LEU . 0.2 OUTLIER -114.56 -65.63 1.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.852 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -120.19 153.2 36.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -99.48 -35.55 9.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.167 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.082 179.978 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 4.6 m120 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.849 0.356 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 66.3 p -59.59 167.17 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.089 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -118.5 164.06 15.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . 0.614 HG11 HD23 ' A' ' 426' ' ' LEU . 21.3 t -95.63 98.92 8.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.025 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.566 ' O ' HG22 ' A' ' 375' ' ' ILE . 18.1 m -94.95 -178.44 4.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.014 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -19.72 64.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.093 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -54.0 -27.9 34.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.214 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.662 ' O ' HG23 ' A' ' 379' ' ' VAL . 0.9 OUTLIER -58.57 -39.32 75.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.123 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.497 ' CD1' HG23 ' A' ' 375' ' ' ILE . 34.3 m-85 -76.63 -34.36 58.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.995 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -30.82 63.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.0 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -68.34 -46.61 69.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.88 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.28 -39.66 79.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.172 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -68.97 -39.02 79.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -74.46 -32.48 62.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.907 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -71.03 -47.85 56.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.59 -34.28 73.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -69.87 -31.71 69.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -44.05 17.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.95 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -68.79 -55.01 12.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.085 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.9 31.61 9.13 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 17.2 pt -109.86 164.02 6.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.81 0.338 . . . . 0.0 111.09 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.89 152.4 41.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -31.11 69.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.91 96.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.134 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.5 t -63.41 -51.9 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -61.68 -31.15 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -74.63 -32.19 62.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.9 ttt85 -72.26 -42.44 65.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.942 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.4 m -78.03 -33.7 18.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.19 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -67.86 -72.24 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.11 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.491 ' CZ ' HD12 ' A' ' 405' ' ' LEU . 3.3 p90 -131.79 114.57 14.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.32 88.8 3.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.923 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -143.92 -74.62 0.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 36.9 p -148.7 171.02 16.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.0 -33.36 10.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.991 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.89 -27.47 72.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.623 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' ' 408' ' ' ILE . 33.3 tp -60.84 -46.02 92.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 394' ' ' ALA . 5.7 tt -56.95 -32.09 65.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.062 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -29.69 40.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.86 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -31.87 59.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.031 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.699 HD11 ' HG ' ' A' ' 404' ' ' LEU . 8.0 mt -73.56 -45.08 52.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.091 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 76.0 mt -72.16 -44.62 62.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.045 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -62.4 -30.72 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.983 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -82.5 -44.51 15.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 61.55 30.51 18.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -86.97 164.86 16.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.786 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -93.18 151.97 40.87 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.39 -22.2 29.53 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.598 2.199 . . . . 0.0 112.457 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -29.95 60.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.155 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 67.9 p -100.91 -31.0 11.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.756 ' CB ' HD13 ' A' ' 422' ' ' LEU . . . -60.37 171.15 1.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.05 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.18 171.76 13.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.91 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.489 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.4 tt0 -59.77 -31.74 69.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 p -58.75 -45.88 88.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.756 HD13 ' CB ' ' A' ' 418' ' ' ALA . 4.8 tt -62.55 -37.53 86.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.98 -31.81 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.782 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -71.25 -44.08 73.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.199 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -73.8 -43.6 58.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.703 HD13 HD21 ' A' ' 422' ' ' LEU . 3.8 tp -60.65 -49.2 78.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.911 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -32.18 70.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.724 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.96 92.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.972 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . 0.451 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 41.1 mtt -62.5 -42.11 99.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.54 -41.3 96.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.836 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -60.31 -52.61 64.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.938 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 443' ' ' ILE . 19.9 t80 -59.23 -46.27 88.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.74 -31.54 72.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.891 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -71.16 -28.37 64.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.018 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 82.9 mt -57.1 153.06 26.33 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.971 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.87 146.87 27.11 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.606 2.204 . . . . 0.0 112.386 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -64.76 -34.01 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.886 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.66 75.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.108 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.9 -51.1 17.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.871 ' HA ' HD12 ' A' ' 443' ' ' ILE . 78.7 mtm180 -58.92 -29.48 67.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -46.92 69.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.171 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -65.75 -29.34 69.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.067 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 440' ' ' ARG . 11.2 mt -73.03 -36.78 51.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.87 0.367 . . . . 0.0 111.026 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -71.38 -31.67 67.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.917 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -79.25 -45.94 18.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.72 119.05 6.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.03 -43.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.017 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -98.46 178.7 4.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -89.42 7.37 36.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.379 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.84 29.22 3.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.715 0.293 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.97 106.21 17.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.815 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.588 HD23 ' N ' ' A' ' 452' ' ' LEU . 1.8 pt? -143.93 -175.88 4.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.911 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -126.48 112.59 15.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.966 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -71.57 178.43 3.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.151 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.084 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 369' ' ' THR . 3.7 t-20 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.843 0.354 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 368' ' ' ASN . 1.1 p -156.21 31.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.44 140.08 57.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 27.7 t -108.64 102.08 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.685 ' O ' HG22 ' A' ' 375' ' ' ILE . 14.4 m -86.55 -174.96 5.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.954 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 63.4 p -71.88 -23.96 61.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.037 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.6 mt-10 -54.18 -27.2 32.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.139 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.685 HG22 ' O ' ' A' ' 372' ' ' SER . 8.3 tp -57.9 -40.95 78.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.138 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.418 ' N ' HG23 ' A' ' 375' ' ' ILE . 93.7 m-85 -73.93 -34.13 64.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.822 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -71.65 -33.07 68.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.421 ' HB3' HD22 ' A' ' 433' ' ' LEU . 53.9 m0 -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 375' ' ' ILE . 31.8 t -60.26 -47.6 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.066 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -40.85 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.803 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.25 -34.7 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.925 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.94 -41.92 73.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 383' ' ' LEU . 12.3 mt -65.91 -44.41 85.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -39.5 89.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -67.17 -51.8 49.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.909 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -66.46 -62.17 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.078 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.52 28.42 7.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.502 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 10.4 pt -100.8 166.71 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 75.1 m -79.39 159.35 27.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.477 ' CG ' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.09 -31.49 70.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -63.26 -38.93 93.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.148 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.506 ' O ' HG22 ' A' ' 396' ' ' VAL . 27.5 t -75.7 -34.51 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 33.1 t80 -73.67 -43.17 60.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.946 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.85 -32.32 72.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -68.56 -55.4 11.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.0 m -64.42 -35.87 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.117 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -71.98 -69.15 0.41 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.205 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.7 p90 -139.68 110.68 6.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.969 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.6 93.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.66 -165.47 2.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.801 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.86 131.09 43.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -59.01 -32.23 69.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.082 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -70.65 -20.6 77.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.703 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.512 ' HG ' HD11 ' A' ' 408' ' ' ILE . 24.0 tp -64.77 -48.02 76.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.915 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.8 tt -57.88 -36.65 72.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.065 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 17.8 p -67.15 -29.89 69.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -80.1 -35.83 36.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.956 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.915 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -66.29 -37.1 78.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.058 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.13 -32.52 33.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -71.07 -49.58 43.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -73.57 -33.7 64.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.93 31.09 20.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . 0.417 ' OE2' HG23 ' A' ' 417' ' ' THR . 9.1 tp10 -64.19 98.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.02 155.45 54.58 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.869 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.567 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 34.3 Cg_endo -64.31 -19.25 65.46 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.656 2.237 . . . . 0.0 112.464 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -58.26 -29.53 65.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.02 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . 0.417 HG23 ' OE2' ' A' ' 413' ' ' GLU . 9.0 t -133.91 19.15 3.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.489 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.567 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -93.68 146.43 23.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.48 179.04 0.65 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.907 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.569 ' O ' HG23 ' A' ' 424' ' ' VAL . 7.4 mm-40 -66.7 -39.32 88.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.051 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -45.14 93.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.746 ' O ' HD13 ' A' ' 422' ' ' LEU . 3.3 tm? -62.13 -33.02 73.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.802 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.53 -32.55 72.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -67.43 -51.1 55.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.142 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -63.44 -36.49 83.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.004 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.12 -38.81 79.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -63.32 -39.86 95.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.3 -38.72 92.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.112 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 3.1 ttm -67.97 -33.66 75.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.855 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -70.25 -39.92 74.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.81 -50.38 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.945 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.65 ' HE1' HD13 ' A' ' 443' ' ' ILE . 68.9 t80 -55.53 -41.39 73.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 378' ' ' TRP . 2.2 mt -68.66 -28.78 67.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -82.48 -22.24 35.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.16 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 34.3 mt -53.93 148.79 19.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.096 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 152.13 16.2 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.578 2.185 . . . . 0.0 112.38 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.53 -36.21 81.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.856 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.06 85.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . 0.447 ' O ' HD12 ' A' ' 443' ' ' ILE . 0.5 OUTLIER -73.34 -40.08 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.928 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.407 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 50.6 mtm-85 -59.45 -46.56 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -43.47 96.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.908 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -50.56 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.978 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.65 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.1 mt -60.62 -30.65 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 16.4 m-85 -75.79 -40.79 54.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -75.34 -42.14 55.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -59.58 93.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -153.16 -49.95 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.953 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . 0.511 ' CD ' HD11 ' A' ' 452' ' ' LEU . 0.4 OUTLIER -69.53 122.19 18.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.804 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -77.95 -177.69 5.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -71.44 -65.57 0.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 121.76 15.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.511 HD11 ' CD ' ' A' ' 448' ' ' ARG . 1.1 mp -104.62 -54.39 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -126.25 86.35 2.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.919 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -66.63 112.8 4.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.099 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.067 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.88 0.371 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.46 143.74 49.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.077 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -87.81 130.24 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.896 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.99 123.07 49.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.1 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.557 ' O ' HG22 ' A' ' 375' ' ' ILE . 69.3 m -90.57 166.38 13.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.912 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 6.2 m -59.38 -21.74 60.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.414 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.2 mt-10 -53.4 -27.78 26.01 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.189 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 379' ' ' VAL . 5.8 tp -58.72 -45.02 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.105 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.484 ' N ' HG23 ' A' ' 375' ' ' ILE . 69.9 m-85 -66.23 -38.95 89.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.799 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -31.03 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.817 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.678 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.0 m0 -68.44 -42.14 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -59.04 -51.05 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.19 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -60.53 -48.94 79.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.57 -35.88 82.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -64.86 -47.03 79.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 69.5 mt -60.91 -44.55 96.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -60.22 -31.58 70.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.003 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -85.41 -38.49 18.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.8 -55.62 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.056 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.09 52.16 3.53 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 22.7 pt -131.24 179.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.824 0.345 . . . . 0.0 111.153 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -89.88 154.49 19.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -31.09 69.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.23 94.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.158 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.659 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.1 t -71.89 -31.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.185 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -75.28 -43.96 48.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.003 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.98 78.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.112 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.91 -59.5 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.874 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.6 m -59.87 -39.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.013 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . 0.438 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -66.13 -72.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.075 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' A' ' 398' ' ' PHE . 4.8 p90 -130.4 97.31 4.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.834 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -60.14 109.73 1.04 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.971 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . 0.716 ' O ' HG23 ' A' ' 401' ' ' THR . 0.6 OUTLIER -154.24 -70.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 400' ' ' ARG . 0.8 OUTLIER -169.4 170.65 8.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.998 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -97.12 131.56 43.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.8 -27.95 6.62 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.545 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.55 -45.8 85.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.797 ' CD2' HD12 ' A' ' 409' ' ' LEU . 7.2 tt -58.54 -41.74 86.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.014 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.5 m -64.41 -30.06 71.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -29.22 42.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.02 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.741 HG23 HD21 ' A' ' 422' ' ' LEU . 7.3 mt -80.37 -39.7 19.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.797 HD12 ' CD2' ' A' ' 405' ' ' LEU . 11.7 mt -76.99 -50.67 12.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.139 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -33.36 71.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.026 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -36.66 81.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 60.64 34.75 20.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -91.29 126.14 36.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -71.42 148.99 93.68 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.954 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.78 -8.39 22.99 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.579 2.186 . . . . 0.0 112.642 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -56.94 -39.42 74.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.793 0.33 . . . . 0.0 111.019 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 80.8 p -125.56 32.49 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.139 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.84 147.77 24.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.106 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 83.1 p -65.66 -178.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 424' ' ' VAL . 3.1 tt0 -72.74 -40.69 65.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 14.4 t -60.37 -43.02 96.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.741 HD21 HG23 ' A' ' 408' ' ' ILE . 3.3 tm? -63.86 -40.98 97.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 75.7 mt -59.18 -30.76 68.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -70.01 -40.2 78.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.037 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -63.25 -37.11 85.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.854 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.726 HD11 ' CD1' ' A' ' 422' ' ' LEU . 13.9 mt -75.57 -32.04 60.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -54.1 43.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.896 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.5 86.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . 0.438 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 7.5 mtm -68.17 -35.5 78.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.851 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -65.75 -41.14 92.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.874 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -60.6 -40.3 91.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.931 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.598 ' HA ' HD12 ' A' ' 435' ' ' LEU . 34.8 t80 -64.18 -32.71 74.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.945 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.678 HD13 ' HB3' ' A' ' 378' ' ' TRP . 37.4 mt -80.76 -28.75 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -70.0 -29.53 66.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.982 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.598 HD12 ' HA ' ' A' ' 432' ' ' PHE . 3.7 mt -58.75 151.54 52.68 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.938 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 156.76 6.97 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.546 2.164 . . . . 0.0 112.317 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -66.05 -37.75 86.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.943 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.89 71.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.077 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.92 -38.25 64.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.925 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.402 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 36.9 mtm-85 -59.59 -47.23 86.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.816 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.41 -37.46 85.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.84 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -37.14 86.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.428 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.5 mt -79.16 -40.83 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.014 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.405 ' HH ' ' HE2' ' A' ' 432' ' ' PHE . 15.8 m-85 -60.84 -43.17 98.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.841 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -29.66 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.913 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.16 -174.32 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.13 -165.96 2.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -96.52 137.04 36.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -60.85 -34.86 75.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.068 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.01 38.59 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.982 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.35 -39.84 18.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.4 mt -72.99 170.42 14.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.023 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.53 156.48 18.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -63.92 176.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.023 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.052 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.883 0.373 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 13.1 p -90.97 140.58 29.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.157 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -102.87 178.61 4.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.8 137.9 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.598 ' O ' HG22 ' A' ' 375' ' ' ILE . 3.1 m -97.98 178.77 5.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.98 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.7 t -69.01 -21.14 64.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.118 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.74 -27.95 20.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.089 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.747 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.2 tp -58.38 -40.28 77.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.595 ' OH ' HD21 ' A' ' 426' ' ' LEU . 97.2 m-85 -74.79 -37.26 62.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.83 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -31.37 70.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.704 ' CB ' HD13 ' A' ' 433' ' ' LEU . 53.0 m0 -70.7 -42.05 71.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.915 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 375' ' ' ILE . 28.0 t -61.8 -48.29 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -49.6 65.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.901 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.75 -45.4 92.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.09 -41.12 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.51 HD23 HG13 ' A' ' 388' ' ' ILE . 5.8 mt -60.21 -31.51 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.962 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.37 -49.75 12.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 3.1 mtt-85 -62.66 -36.78 83.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -79.49 -30.53 42.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 65.5 66.96 2.2 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.482 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.51 HG13 HD23 ' A' ' 383' ' ' LEU . 16.4 pt -143.78 173.43 5.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.809 0.337 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.3 m -91.75 154.04 19.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.945 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.444 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.3 mt-30 -60.12 -30.24 69.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.896 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.31 -41.43 89.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.156 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.6 t -75.57 -51.95 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.38 -29.28 63.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.001 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -71.02 -46.36 62.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.2 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.04 -48.69 80.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.9 m -67.42 -27.99 40.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.208 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -85.06 -76.11 0.33 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.21 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.437 ' CE1' HD12 ' A' ' 405' ' ' LEU . 16.3 p90 -125.53 118.48 25.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.861 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -74.29 107.71 6.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.841 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . 0.645 ' HG3' HG22 ' A' ' 401' ' ' THR . 22.6 tpp180 -154.17 -70.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . 0.645 HG22 ' HG3' ' A' ' 400' ' ' ARG . 1.8 t -169.99 139.18 1.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.107 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -72.73 73.4 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.926 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -179.31 -37.51 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 11.9 tp -61.55 -29.07 69.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.791 0.329 . . . . 0.0 110.964 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.444 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.8 tt -57.49 -37.1 72.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.968 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 89.1 p -72.71 -40.33 66.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.866 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.23 -42.13 99.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.821 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 422' ' ' LEU . 10.6 mt -67.88 -35.09 70.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 28.6 mt -76.21 -34.36 59.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -68.86 -41.7 78.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -60.44 -33.46 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 44.01 31.84 0.56 Allowed 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.406 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 135.34 33.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -67.2 144.7 98.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.489 ' HB3' HD22 ' A' ' 426' ' ' LEU . 85.7 Cg_endo -78.57 -0.66 10.92 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.538 2.159 . . . . 0.0 112.704 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -65.56 -37.02 85.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.987 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.1 p -123.56 25.93 8.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.269 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.506 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.03 174.9 5.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.119 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 70.2 m -69.76 171.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.819 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.797 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.1 pt20 -74.42 -32.01 62.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 16.7 m -61.17 -41.14 96.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.64 HD11 HG23 ' A' ' 408' ' ' ILE . 52.3 tp -69.11 -41.26 77.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.94 -31.68 70.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 420' ' ' GLN . 25.7 t -71.35 -47.63 58.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -64.56 -35.59 81.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.864 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.595 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.5 mp -67.1 -41.36 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.894 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -39.32 86.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.02 -44.12 97.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.9 mtt -63.26 -33.26 75.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.944 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -67.48 -42.39 83.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.15 -47.2 86.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.79 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.647 ' HE1' HD13 ' A' ' 443' ' ' ILE . 32.5 t80 -62.25 -31.15 71.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.704 HD13 ' CB ' ' A' ' 378' ' ' TRP . 18.0 mt -84.59 -23.19 29.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.116 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.87 -31.22 68.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.925 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.682 HD22 ' OE1' ' A' ' 439' ' ' GLU . 12.0 mt -64.98 154.88 85.46 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.74 156.14 59.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.482 2.121 . . . . 0.0 112.237 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -58.68 -30.96 67.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.942 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.37 94.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . 0.682 ' OE1' HD22 ' A' ' 435' ' ' LEU . 16.7 mt-10 -73.72 -37.15 65.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.895 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -59.79 -47.44 85.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.11 -41.35 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.647 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.2 mt -70.53 -32.95 51.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.134 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.427 ' CD1' HD13 ' A' ' 388' ' ' ILE . 14.2 m-85 -68.15 -39.64 82.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -75.36 -44.97 42.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.941 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.43 115.86 3.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.938 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -162.06 143.9 11.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -83.23 115.41 21.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.894 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.27 -26.77 63.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 51.28 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.991 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.02 37.05 1.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 452' ' ' LEU . 3.4 mm? -67.7 143.38 55.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.953 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -131.72 -59.08 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -79.99 92.65 5.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.207 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.131 -179.951 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.819 0.342 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 370' ' ' GLU . 1.3 m -111.9 166.46 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . 0.466 ' H ' HG22 ' A' ' 369' ' ' THR . 51.0 mm-40 -60.46 156.46 16.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.964 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -98.7 109.61 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.158 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.656 ' O ' HG22 ' A' ' 375' ' ' ILE . 10.7 m -85.25 -177.07 6.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.785 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.36 -25.88 61.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.8 mm-40 -54.79 -25.21 26.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.661 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.1 tp -56.99 -42.95 80.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.131 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.607 ' OH ' HD21 ' A' ' 426' ' ' LEU . 84.2 m-85 -72.63 -42.36 64.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -65.82 -31.31 72.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.826 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.442 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 35.6 m0 -67.46 -40.01 85.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -57.9 -59.44 3.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.11 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 45.1 mtt-85 -54.16 -34.91 61.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.99 -30.31 58.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . 0.457 ' OE1' HD21 ' A' ' 433' ' ' LEU . 4.6 tt0 -78.35 -36.17 46.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 393' ' ' PHE . 4.1 mm? -67.54 -44.39 78.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 52.2 tttt -69.76 -45.97 66.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.892 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.61 -54.84 41.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.94 -30.83 69.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.132 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 71.84 40.21 58.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.449 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 29.0 pt -125.37 176.86 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.162 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 95.1 p -91.61 155.42 18.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.989 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -59.19 -27.98 66.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.24 82.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.691 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.6 t -72.53 -31.32 37.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.425 ' CD2' HD21 ' A' ' 383' ' ' LEU . 71.6 t80 -73.39 -48.02 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -59.43 -36.99 76.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -67.35 -62.4 1.44 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 392' ' ' VAL . 30.7 m -59.52 -29.45 42.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.168 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -75.26 -58.77 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.993 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.498 ' HE2' HD23 ' A' ' 404' ' ' LEU . 2.4 p90 -148.27 119.21 7.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.33 99.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -169.39 -168.07 0.77 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.736 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.47 149.36 33.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.053 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.91 -31.6 71.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -66.92 -25.86 73.19 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.553 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.498 HD23 ' HE2' ' A' ' 398' ' ' PHE . 6.7 tp -62.31 -50.36 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 0.0 111.005 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.433 HD21 HD12 ' A' ' 409' ' ' LEU . 7.1 tt -58.51 -38.35 77.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.052 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.3 p -68.6 -30.82 69.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.74 -31.41 52.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.996 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.72 HG23 HD11 ' A' ' 422' ' ' LEU . 9.9 mt -80.35 -30.81 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.987 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.433 HD12 HD21 ' A' ' 405' ' ' LEU . 5.0 mt -79.01 -34.62 43.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.832 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -67.79 -36.9 81.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 19.3 mmtm -60.12 -53.4 58.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 60.28 30.85 20.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -99.86 146.55 26.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.41 139.8 87.08 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.787 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -83.06 50.52 3.37 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.732 2.288 . . . . 0.0 112.606 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -100.05 -40.71 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.891 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.2 p -124.36 30.68 5.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.043 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -93.8 -169.62 2.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.116 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 57.8 m -90.17 172.27 8.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.777 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.9 OUTLIER -69.04 -31.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 92.3 p -59.62 -43.58 93.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.848 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.72 HD11 HG23 ' A' ' 408' ' ' ILE . 13.1 tp -68.21 -34.86 77.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.64 -39.56 84.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.777 HG23 ' O ' ' A' ' 420' ' ' GLN . 26.8 t -66.85 -44.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -64.92 -52.63 55.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.607 HD21 ' OH ' ' A' ' 376' ' ' TYR . 8.1 mp -59.93 -31.26 69.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -44.27 70.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.48 -45.8 82.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.1 mtp -59.85 -34.24 72.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -68.77 -32.4 72.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.49 -34.34 75.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.819 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -69.44 -35.58 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.457 HD21 ' OE1' ' A' ' 382' ' ' GLU . 2.5 mt -79.58 -30.77 41.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -72.79 -27.92 62.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.009 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.32 147.49 57.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.014 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.98 155.92 10.49 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.593 2.195 . . . . 0.0 112.249 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -66.23 -31.75 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.18 77.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.074 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -76.1 -40.17 53.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.864 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.494 ' HA ' HD12 ' A' ' 443' ' ' ILE . 62.2 mtm180 -70.86 -25.62 62.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.106 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.01 -49.5 50.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.062 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -41.91 99.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.094 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.494 HD12 ' HA ' ' A' ' 440' ' ' ARG . 15.8 mt -61.68 -50.17 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.994 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.403 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 12.5 m-85 -61.32 -30.97 70.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.938 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -79.5 -60.76 2.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.839 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.72 108.79 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.86 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.27 -49.82 2.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.883 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 130.57 38.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.946 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.91 -165.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -57.12 -46.79 82.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 86.5 p -75.4 -174.33 2.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.841 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.41 36.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.878 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -101.2 103.64 14.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.953 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -72.57 144.52 47.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.118 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.091 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.1 m120 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.816 0.341 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 59.75 160.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.113 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -129.92 153.42 48.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 29.0 t -70.12 102.57 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.984 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 4.4 m -70.12 169.22 13.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -16.71 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.217 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.433 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 3.1 mp0 -51.36 -28.15 11.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.762 0.315 . . . . 0.0 111.183 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.619 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.0 tp -58.51 -37.78 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.0 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.603 ' HE1' HG22 ' A' ' 408' ' ' ILE . 36.8 m-85 -73.51 -42.95 61.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -64.78 -32.17 73.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.99 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.433 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.9 m0 -66.28 -41.9 89.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.921 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 375' ' ' ILE . 32.5 t -61.15 -35.35 65.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.007 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.19 -31.39 65.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -73.8 -37.92 64.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . 0.563 ' OE2' ' HB2' ' A' ' 386' ' ' ALA . 1.2 tm-20 -76.2 -37.84 57.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.944 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.34 -31.2 71.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.907 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -86.65 -31.26 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.79 -67.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . 0.563 ' HB2' ' OE2' ' A' ' 382' ' ' GLU . . . -59.29 -41.94 90.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 74.18 70.88 1.18 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.488 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.409 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 21.1 pt -134.11 158.0 42.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.055 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.17 160.9 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.802 ' HG2' HD23 ' A' ' 405' ' ' LEU . 2.6 mt-30 -66.19 -31.43 72.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.854 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.09 -28.59 69.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.212 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.826 ' O ' HG22 ' A' ' 396' ' ' VAL . 21.5 t -84.01 -59.54 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.275 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.544 ' CE1' HG13 ' A' ' 379' ' ' VAL . 32.5 t80 -58.02 -26.84 62.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -81.05 -40.51 24.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.27 -39.64 59.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.169 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.826 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.4 m -71.61 -32.05 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.224 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -81.22 -66.51 0.88 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.456 ' CE1' ' HE2' ' A' ' 429' ' ' MET . 16.5 p90 -128.36 114.85 17.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -59.59 109.08 0.82 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -169.57 -172.38 1.42 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 1.1 p -69.84 132.13 45.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.139 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -63.93 154.61 33.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 95.01 -24.5 28.33 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 10.0 tp -58.97 -41.11 86.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.791 0.329 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.802 HD23 ' HG2' ' A' ' 390' ' ' GLN . 2.2 tp -57.38 -33.77 68.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 8.0 t -65.41 -43.74 89.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.932 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -69.08 -41.92 76.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.008 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.603 HG22 ' HE1' ' A' ' 376' ' ' TYR . 25.7 mt -62.58 -40.49 88.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.013 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.463 HD23 ' HD1' ' A' ' 376' ' ' TYR . 58.7 mt -72.18 -37.01 69.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.021 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -44.02 73.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.4 mmmt -58.82 -39.53 81.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.013 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 59.62 30.73 20.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -93.52 109.13 20.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.29 167.6 6.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.409 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 55.3 Cg_endo -69.8 -9.97 27.38 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.505 2.137 . . . . 0.0 112.657 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -30.04 46.23 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.02 32.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.144 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -92.74 177.0 6.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.043 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 5.3 m -89.3 173.42 8.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.0 OUTLIER -61.32 -41.73 97.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.934 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 57.9 m -60.82 -41.71 96.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.873 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.547 ' C ' HD13 ' A' ' 422' ' ' LEU . 3.5 tm? -60.43 -42.47 96.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.847 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 25.7 mt -59.86 -42.24 93.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 420' ' ' GLN . 28.0 t -62.37 -30.45 49.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.097 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . 0.401 ' OD1' ' CE2' ' A' ' 398' ' ' PHE . 1.9 m-80 -70.95 -44.88 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.535 HD11 HD11 ' A' ' 422' ' ' LEU . 28.7 mt -67.39 -44.25 79.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.894 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 11.3 mtt180 -59.88 -40.17 87.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -71.57 -34.62 70.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . 0.456 ' HE2' ' CE1' ' A' ' 398' ' ' PHE . 7.3 mtt -73.35 -33.84 65.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -66.15 -46.71 76.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -64.75 -38.37 90.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.738 ' HA ' HD12 ' A' ' 435' ' ' LEU . 56.8 t80 -71.17 -34.45 70.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 6.0 mt -75.53 -30.68 59.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -72.65 -27.4 62.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.738 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.8 mt -56.64 157.44 10.1 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.86 147.35 32.74 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.618 2.212 . . . . 0.0 112.331 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -63.98 -42.29 97.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.959 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.08 -31.66 70.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.65 -42.46 58.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -60.12 -45.19 93.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -62.23 -38.63 89.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.804 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -37.99 82.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.483 HD13 ' HE1' ' A' ' 432' ' ' PHE . 19.8 mt -73.65 -35.85 45.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.036 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.452 ' HE1' HG21 ' A' ' 396' ' ' VAL . 22.2 m-85 -67.14 -41.07 86.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -84.52 -16.92 40.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.283 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.76 -66.93 0.3 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 61.96 116.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -98.97 134.56 41.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.04 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.35 174.11 0.77 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.816 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.4 60.15 1.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.837 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 19.9 m -91.19 115.47 28.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.855 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.51 170.95 8.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -113.73 171.1 7.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.915 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -69.16 110.28 4.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.071 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.134 -179.96 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.887 0.375 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.7 p -130.26 106.17 8.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.99 40.21 3.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.949 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . 0.43 HG11 HD13 ' A' ' 426' ' ' LEU . 21.5 t -124.22 111.36 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.163 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.65 ' O ' HG22 ' A' ' 375' ' ' ILE . 39.7 m -100.02 173.65 6.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 21.5 t -58.63 -25.42 62.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -55.6 -24.74 34.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.138 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -57.46 -42.54 81.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.116 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.448 ' N ' HG23 ' A' ' 375' ' ' ILE . 87.6 m-85 -72.97 -47.48 45.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.905 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.95 -28.57 66.41 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.042 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . . . . . . . . . 41.5 m0 -68.17 -56.27 9.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.924 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.421 HG22 HD11 ' A' ' 433' ' ' LEU . 22.3 t -58.65 -47.21 89.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -58.37 -38.72 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.66 -41.45 31.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.51 -40.2 95.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.894 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.24 -56.71 17.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.855 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.49 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -69.51 -33.01 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -86.51 -30.68 21.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 70.49 28.43 71.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.57 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 36.3 pt -106.87 164.32 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 151.86 36.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.984 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -60.78 -31.04 70.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.01 -40.21 94.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 26.8 t -73.65 -32.05 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.089 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -75.87 -51.26 12.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -59.62 -31.15 69.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.146 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -70.13 -43.09 71.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.932 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.01 -32.4 12.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.19 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.18 -65.8 0.76 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.193 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -135.78 106.63 6.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -70.28 95.14 0.98 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.87 -71.37 0.46 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.12 131.03 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.152 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.48 125.95 25.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.93 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.54 -27.69 6.8 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.507 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.506 HD23 HD11 ' A' ' 408' ' ' ILE . 5.3 tp -63.16 -33.17 74.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.861 0.362 . . . . 0.0 111.036 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 394' ' ' ALA . 3.4 tt -58.57 -43.3 89.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 59.8 p -67.3 -29.66 69.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.21 -44.25 38.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.506 HD11 HD23 ' A' ' 404' ' ' LEU . 12.7 mt -67.92 -33.55 61.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.156 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.5 mm? -76.95 -30.51 56.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.944 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 -67.62 -37.15 82.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -68.47 -50.9 48.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.96 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 61.24 31.58 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.932 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -95.68 129.92 42.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.834 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.89 165.6 9.62 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.622 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 57.2 Cg_endo -70.65 -8.97 24.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.614 2.209 . . . . 0.0 112.613 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -56.34 -40.66 74.82 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 7.6 t -110.74 -21.6 12.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.369 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -58.25 148.06 28.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.912 0.387 . . . . 0.0 111.109 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 33.9 m -76.89 -178.06 4.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.935 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.831 ' O ' HG23 ' A' ' 424' ' ' VAL . 9.2 tm0? -63.72 -30.45 71.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.923 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 13.9 m -57.4 -50.95 71.36 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.029 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 426' ' ' LEU . 0.7 OUTLIER -64.29 -40.19 95.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.689 ' HA ' HD12 ' A' ' 426' ' ' LEU . 96.3 mt -58.34 -31.99 68.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.0 t -74.07 -32.37 32.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.976 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -74.78 -40.96 60.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 423' ' ' LEU . 2.8 mt -65.68 -40.76 92.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -59.99 -41.17 91.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.814 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.91 94.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -38.83 73.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . 0.465 HE21 HD13 ' A' ' 375' ' ' ILE . 2.5 tt0 -60.9 -45.17 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.72 -39.58 80.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.878 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.58 ' HE1' HD13 ' A' ' 443' ' ' ILE . 86.5 t80 -70.41 -35.73 73.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.421 HD11 HG22 ' A' ' 379' ' ' VAL . 6.5 mt -81.3 -30.93 33.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -70.03 -29.13 66.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.903 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 17.7 mt -58.19 152.53 40.99 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.917 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.03 148.47 23.61 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.524 2.149 . . . . 0.0 112.32 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -60.97 -32.85 72.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -61.03 -38.08 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.047 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . 0.522 ' OE1' HD22 ' A' ' 435' ' ' LEU . 15.9 mt-10 -69.95 -40.2 75.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -60.15 -40.45 89.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -63.73 -37.23 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.01 -41.29 77.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.58 HD13 ' HE1' ' A' ' 432' ' ' PHE . 13.5 mt -69.43 -38.46 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.081 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -67.06 -33.57 75.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.936 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.47 -19.27 23.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.88 115.03 1.63 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.149 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -116.0 -50.75 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.839 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -79.03 127.26 31.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.81 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -86.99 6.39 32.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.455 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -82.52 -17.52 44.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.68 0.276 . . . . 0.0 111.163 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 74.0 m -54.43 -71.43 0.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 111.049 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 5.2 tp -160.86 90.17 0.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -164.65 121.97 1.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -64.82 145.87 55.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.117 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.078 179.954 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.835 0.35 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.0 t -142.86 121.73 12.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.155 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.66 149.21 22.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.919 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.78 143.0 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.549 ' O ' HG22 ' A' ' 375' ' ' ILE . 2.9 m -100.16 168.11 10.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -22.86 64.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.131 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.442 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 84.2 mt-10 -53.74 -26.61 24.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.211 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.695 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.2 tp -57.27 -44.84 84.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.196 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.492 ' N ' HG23 ' A' ' 375' ' ' ILE . 88.4 m-85 -73.22 -34.24 65.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -30.31 65.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.591 ' CB ' HD13 ' A' ' 433' ' ' LEU . 40.7 m0 -71.41 -37.8 71.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.979 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -64.72 -39.78 86.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.198 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 19.5 mtt-85 -67.97 -55.68 11.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -59.45 -30.66 68.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -78.83 -30.77 45.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.013 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 8.7 mt -68.5 -58.36 4.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -41.19 88.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.908 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -64.65 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.95 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.34 -52.32 65.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.067 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 85.36 69.29 1.36 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.413 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.493 HD13 ' CE1' ' A' ' 444' ' ' TYR . 33.9 pt -138.02 176.14 7.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 111.124 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 m -90.57 153.84 20.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.02 -30.94 69.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.88 90.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.093 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 396' ' ' VAL . 29.8 t -74.66 -35.32 37.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.176 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.629 ' CZ ' HG13 ' A' ' 379' ' ' VAL . 42.9 t80 -72.06 -25.97 61.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.091 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.42 -55.5 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.348 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -58.38 -46.93 85.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.059 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.687 HG22 ' O ' ' A' ' 392' ' ' VAL . 27.3 m -63.22 -33.07 58.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.164 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -84.74 -70.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.454 ' CE2' ' HG2' ' A' ' 400' ' ' ARG . 2.0 p90 -143.05 112.85 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.94 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -58.62 124.77 20.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . 0.454 ' HG2' ' CE2' ' A' ' 398' ' ' PHE . 0.0 OUTLIER -170.1 -172.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.91 113.94 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.109 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.29 131.4 10.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.374 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 119.36 -14.36 10.93 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.784 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 6.0 tp -79.76 -43.03 23.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.746 0.307 . . . . 0.0 111.04 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.703 ' O ' HD23 ' A' ' 405' ' ' LEU . 9.2 tt -55.39 -28.38 53.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.21 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 24.9 p -70.95 -50.3 36.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.066 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.29 -41.38 94.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.592 HG23 HD11 ' A' ' 422' ' ' LEU . 28.4 mt -59.88 -44.62 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.019 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.552 HD12 ' CD2' ' A' ' 405' ' ' LEU . 7.4 mt -75.52 -30.61 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -47.6 65.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.895 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -66.89 -41.63 86.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 61.24 31.61 19.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.2 137.85 53.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -75.44 149.6 84.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.833 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.69 -5.74 17.56 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.552 2.168 . . . . 0.0 112.683 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -66.27 -57.59 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.774 0.321 . . . . 0.0 111.064 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 76.4 p -108.67 34.32 3.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.215 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.05 -177.26 3.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.3 174.61 8.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.979 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.655 ' O ' HG23 ' A' ' 424' ' ' VAL . 2.1 mt-30 -71.66 -31.73 67.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.592 HD11 HG23 ' A' ' 408' ' ' ILE . 5.0 tp -63.11 -39.23 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 420' ' ' GLN . 87.0 mt -59.94 -33.99 72.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 420' ' ' GLN . 29.1 t -73.91 -38.14 49.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.071 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -69.28 -50.14 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.938 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.553 HD22 HG21 ' A' ' 375' ' ' ILE . 75.0 mt -57.63 -32.01 66.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.981 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -63.8 -45.56 89.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.25 -43.28 74.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.137 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -35.33 75.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -69.74 -44.27 70.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -64.4 -35.3 80.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.933 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.77 -33.19 72.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 378' ' ' TRP . 11.7 mt -84.66 -30.46 24.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.876 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -70.85 -29.06 65.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.915 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.509 HD22 ' OE2' ' A' ' 439' ' ' GLU . 28.9 mt -57.79 158.72 11.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.31 165.47 30.35 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.639 2.226 . . . . 0.0 112.296 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.21 -33.14 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -60.2 -34.95 74.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . 0.509 ' OE2' HD22 ' A' ' 435' ' ' LEU . 0.5 OUTLIER -74.74 -52.14 12.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.636 ' HA ' HD12 ' A' ' 443' ' ' ILE . 46.9 mtm180 -59.46 -30.54 68.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.996 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.71 -34.74 69.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.996 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -77.1 -31.55 56.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.636 HD12 ' HA ' ' A' ' 440' ' ' ARG . 7.0 mt -75.71 -40.51 40.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.053 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.493 ' CE1' HD13 ' A' ' 388' ' ' ILE . 13.0 m-85 -68.04 -29.48 68.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.042 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -84.71 -54.64 4.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.07 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.61 -178.03 6.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.045 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -162.52 -171.68 2.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.827 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.12 -56.41 2.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.895 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.82 -170.68 1.68 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.889 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -74.51 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.879 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.0 m -83.14 -175.91 6.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.858 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.6 171.17 7.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -134.01 23.86 3.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -100.09 76.39 1.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.098 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.199 179.899 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 9.0 p30 . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.764 0.316 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 13.1 p -64.83 -58.33 6.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.164 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -101.41 170.76 8.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.3 89.07 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.138 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.491 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -64.82 158.27 25.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.017 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.4 m -63.05 -21.41 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.11 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 21.6 mt-10 -53.03 -26.5 15.87 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.13 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.85 ' O ' HG23 ' A' ' 379' ' ' VAL . 6.5 tp -57.85 -42.62 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 111.132 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.584 ' CZ ' HD21 ' A' ' 426' ' ' LEU . 99.2 m-85 -70.47 -44.29 68.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -65.63 -31.34 72.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.947 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 45.6 m0 -70.57 -34.79 72.59 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.8 t -64.74 -37.73 80.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.031 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.8 -38.64 64.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.935 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -73.63 -34.67 65.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.949 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.9 -47.74 50.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.561 HD21 ' CB ' ' A' ' 393' ' ' PHE . 21.9 mt -59.87 -30.88 69.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -81.68 -39.16 24.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -72.81 -32.27 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -76.5 -67.72 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 106.54 58.68 0.6 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.467 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 31.8 pt -141.53 -179.71 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 0.0 111.072 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.41 154.81 17.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.786 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.839 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -58.78 -29.72 67.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.002 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -60.76 -47.35 86.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.161 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -51.64 49.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.15 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.561 ' CB ' HD21 ' A' ' 383' ' ' LEU . 51.6 t80 -58.41 -45.45 88.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.411 ' HB2' HD13 ' A' ' 405' ' ' LEU . . . -63.07 -30.08 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.185 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -51.38 12.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.943 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.51 -36.78 77.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.201 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -68.73 -58.34 4.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.425 ' CE1' HD12 ' A' ' 405' ' ' LEU . 20.3 p90 -150.81 111.05 4.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.097 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -75.22 119.65 19.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.59 -65.94 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.848 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . 0.762 HG23 ' HB2' ' A' ' 404' ' ' LEU . 2.6 t -161.46 146.7 13.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -80.08 147.85 31.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 77.1 3.79 82.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.79 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.762 ' HB2' HG23 ' A' ' 401' ' ' THR . 12.5 tp -88.31 -29.57 20.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.87 0.366 . . . . 0.0 110.93 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 390' ' ' GLN . 6.0 tt -63.66 -20.9 66.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.164 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 85.3 p -68.42 -64.93 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.202 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -53.43 -40.07 64.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.242 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 422' ' ' LEU . 41.6 mt -59.88 -33.2 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.338 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.2 mt -91.23 -30.52 16.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.876 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 15.7 ttp85 -72.67 -40.21 66.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.22 -41.31 92.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.874 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 61.09 31.75 19.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.99 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -78.72 142.61 36.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -85.36 142.58 37.97 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.5 ' HB3' HD23 ' A' ' 423' ' ' LEU . 52.6 Cg_exo -52.4 -25.66 25.41 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.528 2.152 . . . . 0.0 112.43 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -57.43 -47.25 82.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.01 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.7 p -110.42 28.75 8.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.205 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.424 ' CB ' HD23 ' A' ' 422' ' ' LEU . . . -100.13 -178.71 3.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.125 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 74.7 m -99.94 172.48 7.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.778 ' O ' HG23 ' A' ' 424' ' ' VAL . 11.9 mt-30 -62.25 -34.0 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.941 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.27 -46.03 85.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.734 HD11 HG23 ' A' ' 408' ' ' ILE . 7.3 tp -65.36 -40.67 93.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.909 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 420' ' ' GLN . 31.2 mt -59.65 -35.91 75.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.817 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.5 t -78.12 -37.19 22.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.853 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -60.69 -48.48 81.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.79 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.584 HD21 ' CZ ' ' A' ' 376' ' ' TYR . 3.6 mt -65.12 -37.48 87.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.761 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.93 -41.95 97.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.52 -43.96 92.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.018 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.0 mtm -60.67 -34.22 74.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.798 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -64.43 -45.76 86.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.743 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.36 -48.81 80.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.852 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.46 ' HE1' HD13 ' A' ' 443' ' ' ILE . 54.3 t80 -60.63 -31.35 70.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.832 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.34 -28.61 26.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.941 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -69.94 -34.88 74.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.21 146.89 82.54 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.64 152.4 16.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.47 2.113 . . . . 0.0 112.329 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -31.1 69.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.11 93.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.018 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.16 -40.79 74.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.85 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 28.7 mtm-85 -61.87 -38.94 90.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.828 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -66.87 -38.72 86.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -35.41 78.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.863 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.46 HD13 ' HE1' ' A' ' 432' ' ' PHE . 7.5 mt -81.68 -35.37 13.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.09 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.21 -34.7 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.939 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -62.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.941 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -64.12 121.07 13.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -111.46 168.0 9.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.908 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.91 14.63 20.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.301 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -76.57 -39.53 52.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 0.0 111.021 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -97.8 30.76 2.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.874 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.0 p -85.19 -43.52 13.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.2 30.67 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -92.27 -59.85 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -62.79 -31.09 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.103 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.097 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.822 0.344 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 369' ' ' THR . 2.1 t -99.22 98.36 9.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -88.41 129.65 35.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.51 124.23 70.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.077 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.599 ' O ' HG22 ' A' ' 375' ' ' ILE . 4.8 m -86.52 170.25 12.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.992 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -21.74 63.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.423 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 2.5 mp0 -52.15 -28.1 16.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.216 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.6 tp -58.81 -41.54 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.066 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.433 ' N ' HG23 ' A' ' 375' ' ' ILE . 92.0 m-85 -71.09 -36.44 72.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.827 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -69.31 -36.21 76.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.858 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.423 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 53.0 m0 -63.24 -40.48 97.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 375' ' ' ILE . 26.2 t -58.67 -52.58 58.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -60.08 -40.6 90.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.02 -36.51 80.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.02 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.17 -46.61 61.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.03 -35.22 74.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.88 -51.28 9.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.892 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -63.72 -52.24 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.931 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.5 8.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 94.64 59.06 1.15 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.476 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 33.7 pt -138.54 165.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.334 . . . . 0.0 111.089 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.75 157.95 31.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -30.69 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.929 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.93 -36.29 76.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.287 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.49 -52.53 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.141 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -57.02 -30.89 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -82.68 -29.36 29.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.104 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -73.6 -46.7 45.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.958 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.56 -38.1 75.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.17 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -69.15 -57.71 5.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -153.59 105.59 2.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.845 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -73.65 97.25 2.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.942 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 23.8 mtt85 -146.21 -65.35 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.831 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . 0.545 HG22 ' H ' ' A' ' 403' ' ' GLY . 26.3 m -154.16 117.65 4.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.075 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -60.88 -23.08 64.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.209 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . 0.545 ' H ' HG22 ' A' ' 401' ' ' THR . . . -91.17 17.45 55.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.875 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.481 ' HG ' HD11 ' A' ' 408' ' ' ILE . 10.0 tp -100.02 -37.85 8.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.317 . . . . 0.0 110.908 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 1.6 tp -57.92 -42.77 85.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.977 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 3.3 t -64.78 -29.51 70.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.031 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -80.15 -43.15 22.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.481 HD11 ' HG ' ' A' ' 404' ' ' LEU . 10.6 mt -67.97 -42.73 85.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.052 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 25.5 mt -66.57 -33.6 76.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.67 -38.31 73.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -65.9 -49.88 66.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.18 31.05 20.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.919 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.63 135.58 38.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -70.49 127.73 91.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.861 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.73 54.06 5.06 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.511 2.14 . . . . 0.0 112.478 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -100.03 -43.57 6.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.805 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 73.0 p -128.46 31.32 5.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.094 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.34 -178.31 6.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.3 p -77.27 175.05 10.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.856 ' O ' HG23 ' A' ' 424' ' ' VAL . 4.7 mp0 -76.63 -31.44 57.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.932 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 3.2 t -59.46 -39.8 84.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.23 -40.8 64.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.72 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.845 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.856 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.4 t -60.43 -46.98 94.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.991 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -63.82 -46.42 85.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.76 -33.68 75.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.836 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -41.42 99.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.15 -49.73 76.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.994 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 6.4 ttm -66.13 -37.64 86.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -45.82 88.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -61.84 -36.74 82.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.747 ' HE1' HD13 ' A' ' 443' ' ' ILE . 17.1 t80 -68.91 -39.36 79.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.798 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.493 HD11 HG22 ' A' ' 379' ' ' VAL . 5.9 mt -78.21 -32.38 49.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -71.04 -30.71 66.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 432' ' ' PHE . 9.8 mt -58.92 159.5 13.34 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.4 147.83 90.73 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.549 2.166 . . . . 0.0 112.293 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.17 -29.98 67.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.954 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.15 -42.71 86.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.094 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.16 -42.42 65.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.483 ' HA ' HD12 ' A' ' 443' ' ' ILE . 41.6 mtm-85 -59.1 -42.22 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.68 -42.37 96.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.873 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -62.44 -50.05 73.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.747 HD13 ' HE1' ' A' ' 432' ' ' PHE . 5.6 mt -60.01 -42.62 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -65.65 -31.92 73.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -85.55 -3.92 59.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.407 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -97.5 30.67 2.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.791 0.329 . . . . 0.0 111.094 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -83.99 126.27 32.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.907 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -64.41 81.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.99 -169.76 1.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.972 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.54 -24.59 53.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.088 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 10.8 t -55.26 121.29 8.55 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.09 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.731 HD23 ' N ' ' A' ' 453' ' ' ASN . 3.0 tt -138.05 130.24 28.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . 0.731 ' N ' HD23 ' A' ' 452' ' ' LEU . 0.5 OUTLIER -120.24 103.71 9.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.89 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -90.97 -64.06 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.126 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.114 -179.956 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.852 0.358 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.72 96.28 10.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.172 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.35 107.18 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 24.2 t -81.12 122.13 35.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.003 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 375' ' ' ILE . 13.0 m -99.62 169.38 9.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 79.6 p -63.5 -21.75 66.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.116 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 9.2 mm-40 -51.86 -27.16 11.76 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 111.211 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.712 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.1 tp -57.93 -44.88 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.167 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.592 ' OH ' HD21 ' A' ' 426' ' ' LEU . 93.1 m-85 -67.11 -43.6 82.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -67.61 -30.37 69.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.951 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 39.2 m0 -68.15 -42.05 80.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.948 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.3 t -59.53 -43.93 91.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.167 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -60.69 -57.19 13.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -46.36 89.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.29 -33.41 67.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.049 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 17.1 mt -71.14 -30.56 66.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.74 -35.0 24.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.53 -31.71 57.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.41 -44.95 15.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 73.92 63.98 2.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.447 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.497 HD11 ' HD2' ' A' ' 393' ' ' PHE . 41.4 pt -139.52 167.22 20.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.103 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 151.26 30.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.543 ' CG ' HD22 ' A' ' 405' ' ' LEU . 4.5 tt0 -60.29 -31.77 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -61.47 -39.5 91.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.131 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 24.8 t -75.86 -42.35 39.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.099 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.497 ' HD2' HD11 ' A' ' 388' ' ' ILE . 24.3 t80 -60.43 -50.46 73.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.64 -31.56 72.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -62.38 1.71 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.8 m -62.93 -37.06 78.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . 0.481 ' O ' ' HB1' ' A' ' 428' ' ' ALA . . . -67.64 -63.78 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.127 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.458 ' HE2' HD23 ' A' ' 404' ' ' LEU . 9.6 p90 -152.03 109.48 3.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.13 94.37 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.793 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -141.92 -70.11 0.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.793 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -157.41 165.14 36.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.02 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -88.65 -25.16 22.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.069 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -84.48 -26.03 40.78 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.628 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . 0.474 ' HG ' HD11 ' A' ' 408' ' ' ILE . 26.3 tp -58.59 -45.39 89.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.543 HD22 ' CG ' ' A' ' 390' ' ' GLN . 6.2 tt -60.08 -38.29 82.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.947 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 21.4 p -69.82 -31.1 68.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.936 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.26 -40.36 64.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.537 HG22 ' HE2' ' A' ' 376' ' ' TYR . 11.4 mt -72.09 -47.59 53.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.06 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.35 -35.79 81.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.3 -42.37 65.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -48.78 80.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 60.27 32.93 20.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.97 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -91.07 126.6 36.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.922 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.66 151.36 71.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.7 46.49 2.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.769 2.313 . . . . 0.0 112.638 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -100.18 -34.06 10.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.748 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.4 31.15 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -87.42 -174.85 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . 0.483 ' O ' HD23 ' A' ' 423' ' ' LEU . 94.6 p -99.77 179.26 4.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.97 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.658 ' O ' HG23 ' A' ' 424' ' ' VAL . 49.9 tp60 -62.18 -52.27 64.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 2.7 t -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.936 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 422' ' ' LEU . 1.2 tm? -69.91 -33.9 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 419' ' ' SER . 4.2 mm? -77.69 -40.42 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.832 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.5 t -59.62 -48.98 85.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.142 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.54 -42.55 91.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.959 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.592 HD21 ' OH ' ' A' ' 376' ' ' TYR . 5.9 mp -65.05 -32.4 74.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 3.0 ttm105 -65.61 -40.72 92.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' A' ' 397' ' ' ALA . . . -59.82 -50.46 73.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.163 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 26.7 mtm -60.97 -34.27 74.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -70.53 -50.81 33.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.924 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.59 -35.1 75.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.529 ' HA ' HD12 ' A' ' 435' ' ' LEU . 42.0 t80 -74.33 -31.67 62.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 379' ' ' VAL . 21.3 mt -82.29 -31.32 30.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -79.23 -26.34 42.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 432' ' ' PHE . 8.9 mt -55.88 159.66 5.21 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.055 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -51.7 141.74 43.09 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.59 2.193 . . . . 0.0 112.435 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.75 -39.75 95.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.98 -32.38 73.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.49 -40.47 66.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.824 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 444' ' ' TYR . 87.5 mtm-85 -59.63 -41.05 89.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.47 -45.64 93.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -60.92 -41.8 96.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.45 -34.36 52.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.033 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 440' ' ' ARG . 10.9 m-85 -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.988 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -89.59 -52.76 4.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.78 101.53 0.27 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.863 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -118.48 -170.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.814 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -78.26 118.77 20.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.13 174.58 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -53.59 5.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.05 103.07 14.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.886 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.94 64.72 6.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.8 -73.62 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.88 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -64.05 126.4 27.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.076 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.894 0.378 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.9 m 59.06 31.09 21.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.238 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -128.95 121.22 27.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.87 112.38 5.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.429 ' O ' HG22 ' A' ' 375' ' ' ILE . 19.4 m -84.18 175.06 9.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.966 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.6 t -58.6 -21.57 53.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.202 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 4.7 mt-10 -52.55 -26.19 12.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.208 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.0 tp -56.98 -44.36 82.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.133 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.485 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.2 m-85 -69.72 -43.73 71.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -65.45 -31.51 72.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.606 ' HB3' HD13 ' A' ' 433' ' ' LEU . 36.0 m0 -65.49 -45.05 85.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -61.8 -38.67 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.103 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -67.83 -49.15 63.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -31.56 72.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.992 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -77.38 -31.3 54.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.986 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.89 -33.0 67.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.906 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.57 -34.39 35.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.872 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -78.53 -32.12 47.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -83.61 -56.75 3.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 91.94 52.47 2.24 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 4.0 pt -137.65 162.73 31.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.32 . . . . 0.0 111.155 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 19.7 m -74.53 150.46 39.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.686 ' HB3' HD22 ' A' ' 405' ' ' LEU . 79.1 mt-30 -60.19 -28.9 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.927 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.94 -46.4 85.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.223 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 28.8 t -69.92 -41.67 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.005 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.433 ' CE1' HG13 ' A' ' 379' ' ' VAL . 52.1 t80 -59.96 -36.58 77.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.015 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.7 -40.9 88.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -62.98 -51.8 65.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.19 -31.11 50.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.119 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -79.35 -76.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.566 ' HB3' ' HB3' ' A' ' 428' ' ' ALA . 7.2 p90 -126.93 117.99 23.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.71 95.5 6.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.788 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -145.18 -65.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.91 156.98 43.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.031 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -90.3 -32.85 16.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.06 26.79 19.27 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.522 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -99.98 -46.42 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.96 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.781 ' HA ' HD12 ' A' ' 408' ' ' ILE . 3.9 tt -57.89 -34.8 70.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.019 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.36 -30.88 67.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -79.42 -38.87 33.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.994 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.2 mt -63.68 -51.05 75.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 405' ' ' LEU . 4.3 mm? -59.9 -38.96 83.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -37.39 83.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -63.63 -47.73 80.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 60.53 32.01 20.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.952 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.39 149.91 20.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.32 148.59 93.71 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.981 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.553 ' HB3' HD13 ' A' ' 426' ' ' LEU . 69.4 Cg_endo -74.42 -5.74 17.34 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.198 . . . . 0.0 112.602 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.61 -30.99 68.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.087 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.3 t -127.02 21.07 6.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.39 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.98 171.0 15.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . 0.415 ' O ' HD23 ' A' ' 423' ' ' LEU . 32.9 t -74.16 172.54 11.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.767 ' O ' HG23 ' A' ' 424' ' ' VAL . 16.2 pm0 -72.72 -30.42 64.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 52.1 p -67.94 -42.4 81.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.856 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 426' ' ' LEU . 1.1 tt -67.67 -40.75 84.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.507 ' HA ' HD12 ' A' ' 426' ' ' LEU . 2.7 mm? -57.77 -32.71 67.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 420' ' ' GLN . 33.5 t -72.64 -35.4 50.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.984 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.77 -43.59 68.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.647 HD11 HD22 ' A' ' 422' ' ' LEU . 11.3 mt -60.07 -33.57 72.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -62.25 -56.29 20.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.566 ' HB3' ' HB3' ' A' ' 398' ' ' PHE . . . -62.86 -32.48 73.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.104 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 12.0 mtm -71.57 -36.57 70.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -66.74 -44.62 81.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.945 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -60.07 -46.01 90.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.609 ' HA ' HD12 ' A' ' 435' ' ' LEU . 20.8 t80 -58.14 -41.26 83.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.001 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.606 HD13 ' HB3' ' A' ' 378' ' ' TRP . 7.8 mt -71.49 -27.91 63.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.002 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -80.47 -25.03 39.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.166 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 432' ' ' PHE . 48.9 mt -55.36 154.14 12.28 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.014 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.34 145.59 35.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.568 2.179 . . . . 0.0 112.328 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -63.74 -35.04 79.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.66 -37.89 79.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -75.22 -42.0 56.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -59.27 -40.33 85.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -64.09 -42.74 96.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -47.56 80.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . . . . . . . . . 31.3 mt -59.55 -34.43 54.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.949 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -73.02 -43.25 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.723 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -100.08 25.09 7.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.975 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.78 102.53 0.35 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -147.7 140.35 24.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.952 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 117.98 12.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -37.24 62.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.949 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -100.12 44.76 1.01 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.48 101.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.966 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -143.06 -48.7 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -72.99 120.47 18.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -68.01 -32.07 72.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.066 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.017 -179.941 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.818 0.342 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . 0.416 HG22 HG23 ' A' ' 371' ' ' VAL . 3.1 m -91.36 96.38 10.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.127 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -95.57 86.6 4.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.872 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . 0.416 HG23 HG22 ' A' ' 369' ' ' THR . 25.2 t -92.66 80.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.102 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.765 ' O ' HG22 ' A' ' 375' ' ' ILE . 31.2 m -100.01 -174.38 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 10.4 t -58.15 -23.44 55.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.092 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.436 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 5.2 mm-40 -55.52 -28.66 56.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.083 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.801 ' O ' HG23 ' A' ' 379' ' ' VAL . 2.1 tp -59.19 -32.58 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.92 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.562 ' HE2' HG22 ' A' ' 408' ' ' ILE . 82.0 m-85 -77.86 -42.86 32.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.94 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -32.73 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.944 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 51.1 m0 -69.03 -44.92 71.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.012 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 375' ' ' ILE . 37.0 t -61.42 -40.86 87.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.06 -30.77 61.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -45.75 48.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.962 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.36 -35.93 82.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 383' ' ' LEU . 13.3 mt -67.54 -32.91 74.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -79.54 -44.24 21.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -33.97 75.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.32 -69.1 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.071 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 99.32 61.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.434 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 23.8 pt -137.5 164.67 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 0.0 111.116 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 1.6 p -72.32 152.43 42.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.435 ' HG2' HD22 ' A' ' 405' ' ' LEU . 6.2 mt-30 -62.42 -31.11 71.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.27 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 32.4 t -79.73 -40.9 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.566 ' CE2' HG13 ' A' ' 379' ' ' VAL . 48.1 t80 -68.21 -50.33 54.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -60.74 -37.55 82.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 22.2 ttt-85 -60.63 -41.22 94.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.832 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.406 ' HB ' ' CE1' ' A' ' 432' ' ' PHE . 26.9 m -85.89 -30.4 6.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.84 -65.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.106 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . 0.495 ' CE1' HD12 ' A' ' 405' ' ' LEU . 3.8 p90 -143.47 102.62 3.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -68.61 97.49 0.8 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.829 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -142.07 -70.67 0.34 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.32 143.53 16.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.061 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -77.64 125.78 29.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.974 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 112.05 -28.47 9.26 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.428 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.03 -31.4 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.763 ' HA ' HD12 ' A' ' 408' ' ' ILE . 5.8 tt -59.21 -47.47 85.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -31.41 72.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.903 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -68.45 -39.57 81.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.988 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.6 mt -64.96 -35.7 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.031 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.62 -35.16 45.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.925 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -71.33 -42.89 67.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 60.29 34.3 20.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.975 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.38 142.83 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.966 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.11 149.71 89.67 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.99 -11.37 29.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.571 2.18 . . . . 0.0 112.585 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -68.62 -38.89 80.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.859 0.361 . . . . 0.0 110.966 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 2.0 m -99.78 -26.87 13.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.265 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -55.58 176.38 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.243 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 43.4 t -82.76 175.93 9.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.669 ' O ' HG23 ' A' ' 424' ' ' VAL . 0.0 OUTLIER -70.7 -31.05 67.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.856 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 1.2 m -58.84 -46.6 87.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.828 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.709 HD11 HG23 ' A' ' 408' ' ' ILE . 11.5 tp -65.03 -38.91 92.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.818 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 420' ' ' GLN . 2.6 mt -59.83 -31.2 69.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.815 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 420' ' ' GLN . 30.6 t -74.11 -47.38 42.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.065 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -63.75 -42.46 97.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.13 -35.16 74.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -63.51 -39.15 93.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.03 89.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.54 -36.84 79.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -66.34 -46.94 75.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -60.63 -52.94 62.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.64 ' HE1' HD13 ' A' ' 443' ' ' ILE . 66.6 t80 -57.46 -40.62 78.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.987 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.32 -26.42 61.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -72.82 -28.2 62.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.87 149.24 55.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.924 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.7 161.49 4.4 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.602 2.201 . . . . 0.0 112.34 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.39 -31.51 72.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.08 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -71.01 -42.83 69.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.409 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 78.1 mtm-85 -64.56 -42.87 95.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.07 -34.44 78.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -67.35 -47.4 70.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.837 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.64 HD13 ' HE1' ' A' ' 432' ' ' PHE . 8.4 mt -63.57 -47.26 92.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 440' ' ' ARG . 21.2 m-85 -60.77 -34.2 74.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.862 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.83 8.72 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.311 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.06 113.47 22.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.841 0.353 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.25 -61.51 1.93 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.1 mtm-85 -89.86 129.89 36.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.53 -33.28 71.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.856 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -87.62 -60.02 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.86 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 73.1 m -69.37 107.3 3.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.89 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.2 mp -100.88 -31.69 11.02 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.838 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -100.27 -64.18 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.902 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -59.86 162.6 5.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.171 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.098 179.931 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 4.9 p -137.05 -63.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.199 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.9 156.7 48.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.937 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.95 133.51 29.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.031 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 31.5 m -97.07 177.51 5.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.951 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 39.7 t -66.2 -15.47 63.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.321 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.17 -29.35 21.88 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.082 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 379' ' ' VAL . 1.5 tp -59.87 -40.18 82.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.036 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.432 ' CD1' HG23 ' A' ' 375' ' ' ILE . 86.5 m-85 -70.97 -38.3 72.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -71.49 -31.35 67.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.432 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 44.2 m0 -65.48 -44.44 87.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.791 HG13 ' CE1' ' A' ' 393' ' ' PHE . 22.0 t -68.64 -43.11 83.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.074 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 34.5 mtt180 -60.38 -44.62 95.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.87 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -69.46 -37.23 77.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -43.68 94.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 59.4 mt -60.41 -38.2 83.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.833 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -78.36 -31.82 48.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 11.5 mtt-85 -64.87 -65.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -74.12 -30.87 62.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.181 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 76.52 45.82 13.13 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.522 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . . . . . . . . . 27.7 pt -108.11 165.07 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.82 0.343 . . . . 0.0 111.179 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 43.8 m -81.67 154.03 26.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.515 ' HG2' HD22 ' A' ' 405' ' ' LEU . 4.0 mt-30 -60.39 -29.2 68.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.995 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -57.97 -45.09 87.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.504 ' O ' HG22 ' A' ' 396' ' ' VAL . 22.2 t -70.66 -49.9 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.791 ' CE1' HG13 ' A' ' 379' ' ' VAL . 37.5 t80 -61.87 -41.02 97.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.9 70.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.161 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -48.18 16.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.924 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 392' ' ' VAL . 16.7 m -73.79 -29.1 25.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.225 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -73.78 -60.96 2.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.131 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -146.89 105.88 3.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -74.29 100.67 3.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.35 -69.38 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 2.2 p -153.03 134.04 14.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.156 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.47 139.75 45.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 99.35 -24.59 31.6 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.581 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 5.6 tp -62.75 -36.16 82.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.961 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.515 HD22 ' HG2' ' A' ' 390' ' ' GLN . 9.1 tt -58.56 -46.85 86.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.028 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -28.85 66.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.965 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -78.71 -41.68 30.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 422' ' ' LEU . 19.3 mt -65.7 -38.9 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.072 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 409' ' ' LEU . 13.5 mt -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.982 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -69.45 -31.42 69.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 20.3 mttp -85.2 -45.84 11.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 61.28 31.95 19.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.814 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.24 169.96 9.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.08 130.37 26.31 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.832 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.639 ' HG3' HD13 ' A' ' 426' ' ' LEU . 52.2 Cg_exo -52.66 -25.92 27.9 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.465 2.11 . . . . 0.0 112.364 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -58.13 -33.75 69.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.999 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 8.9 t -111.32 -19.82 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.353 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -53.78 173.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.9 0.381 . . . . 0.0 111.311 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 53.0 m -81.25 -179.78 7.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.751 ' HA ' HD12 ' A' ' 423' ' ' LEU . 0.0 OUTLIER -72.74 -36.93 67.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.846 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.82 -46.23 88.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.879 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.745 HD11 HG23 ' A' ' 408' ' ' ILE . 3.2 tp -61.83 -39.9 93.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.751 HD12 ' HA ' ' A' ' 420' ' ' GLN . 13.2 mt -59.07 -32.88 70.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.738 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 420' ' ' GLN . 22.2 t -77.67 -34.91 20.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.04 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -72.37 -47.32 50.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.639 HD13 ' HG3' ' A' ' 415' ' ' PRO . 25.1 mt -61.57 -34.89 76.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.785 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.3 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.79 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.49 87.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.989 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.1 mtp -64.79 -35.67 81.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.808 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -62.86 -45.9 90.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.763 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -61.95 -42.96 99.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.812 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.476 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.1 t80 -63.03 -44.05 97.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.77 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.42 HD13 ' HB3' ' A' ' 378' ' ' TRP . 22.6 mt -71.58 -25.82 62.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.041 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -69.88 -29.38 66.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.95 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . . . . . . . . . 60.3 mt -58.94 154.81 36.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.968 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.27 162.87 38.54 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.624 2.216 . . . . 0.0 112.275 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -59.63 -37.21 78.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.956 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.74 -38.93 92.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.08 -41.77 58.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.488 ' HA ' HD12 ' A' ' 443' ' ' ILE . 66.8 mtm180 -59.81 -45.82 91.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -62.44 -39.06 92.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -62.81 -35.55 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 440' ' ' ARG . 8.7 mt -76.48 -34.12 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.06 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -66.16 -54.07 29.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -60.7 -37.8 82.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.955 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -72.92 97.94 2.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -127.71 143.85 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.947 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.84 30.84 3.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -95.46 -62.49 1.29 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.961 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.88 31.84 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.929 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . 0.468 ' C ' HD12 ' A' ' 452' ' ' LEU . 1.3 m -74.34 109.6 7.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.468 HD12 ' C ' ' A' ' 451' ' ' SER . 10.9 mp -122.39 49.04 1.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -59.59 116.88 4.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.899 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -74.64 -62.54 1.5 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.149 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.192 -0.909 . . . . 0.0 111.132 179.961 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.732 0.301 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.39 30.98 8.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.079 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -162.03 121.54 2.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . 0.648 HG11 HD23 ' A' ' 426' ' ' LEU . 21.8 t -114.52 113.63 44.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.191 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.787 ' O ' HG22 ' A' ' 375' ' ' ILE . 0.9 OUTLIER -100.04 -175.22 2.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -23.95 63.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.119 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.02 -28.55 62.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.787 HG22 ' O ' ' A' ' 372' ' ' SER . 6.0 tp -58.01 -35.73 53.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.146 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -76.65 -40.36 49.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.864 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -69.46 -30.97 68.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.794 ' HB3' HD13 ' A' ' 433' ' ' LEU . 49.9 m0 -67.79 -43.07 80.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.952 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.4 t -58.82 -44.55 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.129 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -72.18 -49.11 38.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.975 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.9 -30.53 69.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.992 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -80.91 -38.49 27.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.995 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 HG13 ' A' ' 388' ' ' ILE . 7.1 mt -64.95 -40.41 94.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.969 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 -32.14 65.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.995 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.51 -31.35 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -82.06 -52.82 6.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 88.15 72.09 1.28 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.502 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.54 HD13 ' CE1' ' A' ' 444' ' ' TYR . 21.4 pt -148.77 173.59 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 111.158 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 3.2 m -90.41 152.6 20.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.5 ' HG2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -60.57 -30.82 70.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.862 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.64 98.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.127 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.587 ' O ' HG22 ' A' ' 396' ' ' VAL . 32.8 t -70.61 -48.21 59.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.161 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -58.28 -48.65 79.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.416 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -60.53 -30.71 69.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -76.0 -55.28 5.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.867 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 392' ' ' VAL . 23.9 m -67.04 -27.91 41.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.211 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -77.4 -73.85 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -128.92 113.08 14.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -78.8 90.54 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.831 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . 0.621 ' O ' HG23 ' A' ' 401' ' ' THR . 7.4 tpt180 -132.77 -66.19 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . 0.621 HG23 ' O ' ' A' ' 400' ' ' ARG . 1.0 OUTLIER -163.84 155.67 16.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 8.3 tm0? -85.19 137.69 32.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.7 -27.57 17.2 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.78 -31.49 69.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 110.932 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.613 ' HA ' HD12 ' A' ' 408' ' ' ILE . 7.7 tt -60.44 -48.46 81.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 9.5 m -61.54 -38.66 88.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -40.68 90.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.002 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 405' ' ' LEU . 7.4 mt -67.7 -37.28 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.118 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . . . . . . . . . 91.9 mt -79.22 -27.69 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.998 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.68 -31.01 64.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -69.05 -42.81 75.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 61.25 27.59 17.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.979 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.0 161.6 13.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.864 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.0 142.78 25.26 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.979 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 49.9 Cg_exo -54.85 -19.86 20.6 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.38 2.053 . . . . 0.0 112.584 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -49.17 -27.98 4.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.327 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 1.6 p -125.02 20.95 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.453 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -100.19 -173.02 2.32 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.05 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.05 178.66 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.752 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 423' ' ' LEU . 1.1 tp-100 -70.03 -31.03 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 22.6 t -58.94 -49.94 75.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 18.2 tp -62.08 -38.32 88.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 420' ' ' GLN . 50.0 mt -59.63 -30.81 68.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.815 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 420' ' ' GLN . 21.6 t -71.98 -50.12 39.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.204 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -60.55 -44.04 96.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.648 HD23 HG11 ' A' ' 371' ' ' VAL . 7.9 mp -65.68 -31.54 72.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.22 -51.37 69.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.27 -32.16 70.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -67.47 -44.29 78.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . 0.429 ' HB2' HD13 ' A' ' 375' ' ' ILE . 8.5 tt0 -64.08 -44.96 90.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -60.36 -40.83 92.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.54 ' HA ' HD12 ' A' ' 435' ' ' LEU . 44.2 t80 -66.09 -33.6 76.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.785 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.794 HD13 ' HB3' ' A' ' 378' ' ' TRP . 13.4 mt -83.74 -27.74 28.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.998 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -74.9 -28.18 60.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.984 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 432' ' ' PHE . 1.0 OUTLIER -56.92 161.89 4.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . 0.516 ' HD2' HD23 ' A' ' 435' ' ' LEU . 41.5 Cg_endo -67.33 148.39 79.74 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.513 2.142 . . . . 0.0 112.32 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.46 -31.29 69.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.963 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -59.79 -46.07 90.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -45.16 68.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.961 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -58.19 -36.86 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.29 -37.58 87.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.811 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -75.0 -34.59 61.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.823 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 443' ' ' ILE . 9.8 mt -75.75 -10.88 13.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.459 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.54 ' CE1' HD13 ' A' ' 388' ' ' ILE . 4.8 m-85 -95.76 -29.63 14.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -96.2 -16.35 21.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.436 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 52.7 p-10 -68.64 71.05 0.2 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.928 0.394 . . . . 0.0 111.041 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.14 134.59 55.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.93 120.95 24.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.881 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -77.38 -8.46 57.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.343 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.01 -30.31 59.22 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.804 0.335 . . . . 0.0 111.003 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 1.3 t -65.56 -169.71 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.12 146.64 47.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.814 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -60.49 159.87 9.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -97.69 37.89 1.34 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.121 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.08 -179.973 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 10.6 m120 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.762 0.315 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 2.8 p -135.73 131.77 36.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.04 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -95.54 122.47 38.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.833 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 21.7 t -110.35 133.15 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 375' ' ' ILE . 5.0 m -99.8 163.1 12.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 1.2 t -66.31 -20.88 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.6 -27.53 11.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.853 0.359 . . . . 0.0 111.199 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.7 ' O ' HG23 ' A' ' 379' ' ' VAL . 8.9 tp -58.02 -44.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.109 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.591 ' HE1' HG22 ' A' ' 408' ' ' ILE . 76.9 m-85 -66.85 -40.83 88.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -66.91 -32.35 73.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.413 ' HB3' HD13 ' A' ' 433' ' ' LEU . 54.6 m0 -69.07 -46.75 67.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.933 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 375' ' ' ILE . 21.5 t -60.53 -33.3 53.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.028 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -74.13 -43.55 57.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.813 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.21 -35.55 71.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.833 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.77 -36.49 78.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.891 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -35.83 79.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.851 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -72.46 -38.85 68.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -43.95 57.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.828 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -73.73 -32.02 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 64.54 30.81 78.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.512 HD13 ' CE1' ' A' ' 444' ' ' TYR . 42.6 pt -102.45 162.19 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.745 0.307 . . . . 0.0 111.154 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.42 151.78 42.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.57 ' HB3' HD22 ' A' ' 405' ' ' LEU . 52.8 mt-30 -62.76 -31.67 72.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.09 96.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.02 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . . . . . . . . . 30.0 t -70.9 -43.12 77.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -61.99 -44.78 96.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.5 ' HB2' ' CD1' ' A' ' 405' ' ' LEU . . . -65.33 -30.56 71.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.138 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -72.86 -35.33 67.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -87.99 -31.48 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . 0.421 ' HB1' ' HG2' ' A' ' 429' ' ' MET . . . -78.53 -63.03 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.086 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -140.12 98.42 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 97.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.919 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -136.37 -67.0 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 66.8 p -156.37 147.38 22.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.092 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.9 136.85 38.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 98.26 -27.42 19.43 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.582 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 9.8 tp -59.4 -36.03 75.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.601 ' O ' HD23 ' A' ' 409' ' ' LEU . 10.0 tt -59.88 -31.07 69.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.959 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 54.3 m -74.99 -44.92 45.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.98 -41.04 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.938 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.591 HG22 ' HE1' ' A' ' 376' ' ' TYR . 13.6 mt -69.38 -32.27 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.008 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 405' ' ' LEU . 3.8 mm? -81.55 -30.67 33.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -44.1 61.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -45.52 91.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.952 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.99 31.3 19.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.34 151.72 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.05 146.57 63.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.94 -27.31 14.41 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.524 2.15 . . . . 0.0 112.405 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -58.39 -33.06 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.975 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 24.9 p -114.88 27.24 9.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.207 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -100.06 -169.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 18.5 m -99.59 173.13 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.873 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.884 ' O ' HG23 ' A' ' 424' ' ' VAL . 1.6 mm100 -62.79 -47.58 82.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.851 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 6.3 p -59.31 -39.82 84.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.738 ' O ' HD13 ' A' ' 422' ' ' LEU . 3.2 tm? -68.82 -34.58 75.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.887 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.66 -35.43 67.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 420' ' ' GLN . 24.1 t -65.69 -47.41 86.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.028 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -65.54 -37.65 87.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.93 -35.28 78.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.37 -44.9 95.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.987 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.12 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.043 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . 0.421 ' HG2' ' HB1' ' A' ' 397' ' ' ALA . 2.6 mtm -64.78 -36.37 84.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.863 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . 0.455 ' HG3' HD13 ' A' ' 375' ' ' ILE . 15.2 tt0 -67.95 -42.87 80.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.28 -40.95 97.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.468 ' HE1' HD13 ' A' ' 443' ' ' ILE . 73.9 t80 -62.97 -35.7 81.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.845 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 378' ' ' TRP . 11.3 mt -79.49 -26.63 41.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.934 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -70.0 -28.28 65.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.928 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.423 HD13 ' OE1' ' A' ' 439' ' ' GLU . 80.0 mt -57.98 155.3 24.67 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.97 163.5 35.46 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.559 2.173 . . . . 0.0 112.286 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -59.58 -31.47 69.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.52 75.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.192 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . 0.423 ' OE1' HD13 ' A' ' 435' ' ' LEU . 4.5 mm-40 -75.35 -51.61 12.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.406 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 6.2 mtp180 -58.76 -38.64 78.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.905 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.1 -47.99 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.951 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -39.8 77.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.033 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.468 HD13 ' HE1' ' A' ' 432' ' ' PHE . 18.0 mt -73.07 -45.36 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.14 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.512 ' CE1' HD13 ' A' ' 388' ' ' ILE . 16.2 m-85 -62.96 -49.95 72.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.94 -28.41 67.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.28 77.01 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.939 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -177.89 148.05 0.5 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 40.4 mtt-85 -61.59 -76.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -99.96 172.72 7.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.894 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.98 -64.74 1.01 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.89 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 2.3 t -99.97 -66.53 0.9 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.995 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.535 HD12 ' H ' ' A' ' 452' ' ' LEU . 1.3 mp -65.37 154.24 38.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -140.05 117.67 11.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -71.74 157.88 37.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.177 -0.916 . . . . 0.0 111.128 179.997 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.847 0.356 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 6.6 t -173.04 142.49 1.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.15 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -91.13 151.19 21.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . 0.501 HG22 ' NE2' ' A' ' 430' ' ' GLN . 7.9 t -70.04 94.74 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.596 ' O ' HG22 ' A' ' 375' ' ' ILE . 67.5 m -62.78 -177.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.003 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 3.4 m -66.93 -22.35 65.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.054 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . 0.435 ' HB3' ' CE2' ' A' ' 378' ' ' TRP . 36.5 mt-10 -51.02 -27.39 7.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.175 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.639 ' O ' HG23 ' A' ' 379' ' ' VAL . 7.4 tp -59.58 -44.89 94.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.575 ' HE1' HG22 ' A' ' 408' ' ' ILE . 88.5 m-85 -65.74 -36.87 84.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.04 -31.01 68.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.435 ' CE2' ' HB3' ' A' ' 374' ' ' GLU . 42.1 m0 -72.05 -45.91 58.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.779 HG22 HD11 ' A' ' 433' ' ' LEU . 30.4 t -60.47 -33.57 54.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.033 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -69.3 -41.25 77.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -37.0 50.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.951 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -61.21 -39.14 89.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.963 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 26.8 mt -74.14 -32.2 63.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.21 -31.56 62.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.967 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 16.0 mmt85 -77.96 -62.2 1.75 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.911 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.51 -38.35 84.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.111 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 69.82 64.39 2.94 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.448 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.452 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 25.2 pt -131.56 157.28 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.759 0.314 . . . . 0.0 111.181 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . 0.666 ' OG ' HG23 ' A' ' 392' ' ' VAL . 4.9 p -65.0 157.07 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.551 ' NE2' HD22 ' A' ' 405' ' ' LEU . 0.0 OUTLIER -68.13 -34.55 76.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.872 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -59.71 -30.88 69.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.108 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.666 HG23 ' OG ' ' A' ' 389' ' ' SER . 30.0 t -77.1 -50.66 20.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.072 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . 0.414 ' HA ' HG22 ' A' ' 396' ' ' VAL . 16.2 t80 -64.68 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -66.65 -41.79 87.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.167 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -47.65 70.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.847 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 392' ' ' VAL . 35.7 m -69.43 -37.89 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.186 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -72.27 -70.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.155 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -134.49 113.28 11.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.857 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -60.34 96.54 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.86 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -147.79 178.82 8.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.759 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.01 151.0 46.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -67.95 149.24 50.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.946 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . 96.29 -27.72 15.92 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.542 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.87 -34.09 74.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.834 0.35 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 408' ' ' ILE . 4.3 tt -59.76 -50.44 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 2.8 p -60.27 -30.64 69.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -71.49 -33.22 69.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.957 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 405' ' ' LEU . 6.9 mt -77.2 -36.25 24.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.489 HD23 HD23 ' A' ' 405' ' ' LEU . 4.0 mm? -74.09 -35.18 64.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -55.66 5.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -60.07 -48.41 81.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.878 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 60.13 30.96 20.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.989 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.8 115.68 6.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.49 149.17 84.64 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.429 ' HG3' ' HB ' ' A' ' 371' ' ' VAL . 94.1 Cg_endo -83.49 47.36 2.33 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.844 2.363 . . . . 0.0 112.823 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -100.15 -50.87 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 0.0 110.91 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.11 30.7 6.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -90.84 -177.48 4.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.087 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . 0.6 ' O ' HD23 ' A' ' 423' ' ' LEU . 0.3 OUTLIER -87.5 178.58 6.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 179.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.893 ' O ' HG23 ' A' ' 424' ' ' VAL . 74.3 mt-30 -75.14 -30.22 60.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.964 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -50.5 73.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.089 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 56.0 tp -64.72 -41.43 95.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 419' ' ' SER . 3.7 mm? -58.65 -38.87 79.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 420' ' ' GLN . 32.2 t -67.52 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -42.33 54.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.786 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 2.4 mp -63.18 -42.3 99.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.795 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -60.53 -40.92 93.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.29 99.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.063 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.9 mtm -70.14 -34.93 73.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.822 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . 0.501 ' NE2' HG22 ' A' ' 371' ' ' VAL . 25.3 tt0 -69.02 -47.09 66.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.715 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -59.64 -37.59 79.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.503 ' HA ' HD12 ' A' ' 435' ' ' LEU . 3.5 t80 -67.88 -44.55 76.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.779 HD11 HG22 ' A' ' 379' ' ' VAL . 18.2 mt -72.49 -33.22 66.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.811 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -69.89 -31.61 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.786 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 432' ' ' PHE . 14.3 mt -59.15 159.86 13.6 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.49 148.29 87.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.464 2.109 . . . . 0.0 112.32 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.7 -30.03 67.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.994 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -57.82 -40.48 80.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.119 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -51.81 23.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.448 ' HA ' HD12 ' A' ' 443' ' ' ILE . 86.7 mtm-85 -59.72 -30.79 69.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -55.54 31.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.932 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.76 -43.99 97.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.976 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.481 HD13 ' HE1' ' A' ' 432' ' ' PHE . 24.4 mt -58.93 -30.68 43.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.048 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.452 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 15.0 m-85 -87.47 -38.25 16.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.832 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -100.12 27.7 5.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -77.42 -175.4 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.76 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -108.07 114.51 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -65.53 78.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.791 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -94.23 -176.03 3.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.1 57.32 4.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.846 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 2.9 p -95.52 43.71 1.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.991 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -147.96 117.46 7.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.903 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -117.48 42.03 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.81 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -77.28 138.14 39.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.995 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 368' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.863 0.363 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 369' ' ' THR . . . . . . . . . . . . . 3.8 t -98.07 -32.54 11.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.1 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -90.42 166.59 13.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 371' ' ' VAL . . . . . . . . . . . . . 30.8 t -103.58 109.7 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 375' ' ' ILE . 1.6 m -95.1 -176.69 3.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.951 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 373' ' ' SER . . . . . . . . . . . . . 66.4 m -66.61 -20.92 66.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.222 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -51.74 -29.62 19.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.877 0.37 . . . . 0.0 111.167 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 372' ' ' SER . 1.0 OUTLIER -59.43 -44.23 92.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.11 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 376' ' ' TYR . . . . . 0.476 ' N ' HG23 ' A' ' 375' ' ' ILE . 70.9 m-85 -62.93 -48.77 77.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -32.25 68.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.754 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 378' ' ' TRP . . . . . 0.436 ' CE3' ' HA ' ' A' ' 375' ' ' ILE . 54.4 m0 -64.1 -48.62 75.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.086 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . . . . . . . . . 23.2 t -57.27 -42.12 79.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.353 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -60.58 -44.19 96.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -73.4 -41.84 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 382' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -42.37 95.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.048 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 383' ' ' LEU . 15.0 mt -60.32 -49.47 77.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.861 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 384' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -70.03 -37.89 75.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 385' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -67.06 0.46 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 386' ' ' ALA . . . . . . . . . . . . . . . -60.04 -45.34 93.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.191 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . 84.92 72.88 1.28 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.429 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 388' ' ' ILE . . . . . 0.421 ' CD1' ' CE1' ' A' ' 444' ' ' TYR . 19.5 pt -148.41 156.17 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.833 0.349 . . . . 0.0 111.127 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.01 152.96 42.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.895 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.34 -30.07 69.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.868 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 391' ' ' ALA . . . . . . . . . . . . . . . -58.52 -38.19 77.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.144 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 392' ' ' VAL . . . . . 0.626 ' O ' HG22 ' A' ' 396' ' ' VAL . 30.2 t -77.9 -50.51 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.006 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -58.2 -35.02 71.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.014 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.76 61.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.087 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -31.26 41.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 392' ' ' VAL . 29.8 m -89.0 -27.9 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.181 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 397' ' ' ALA . . . . . . . . . . . . . . . -76.58 -61.6 1.91 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 398' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -146.13 119.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.894 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -76.45 101.4 5.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.986 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.29 -65.9 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 401' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.65 155.78 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.054 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 402' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.09 -32.98 39.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.945 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 403' ' ' GLY . . . . . . . . . . . . . . . -96.29 27.16 18.14 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.56 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . 13.6 tp -100.09 -38.17 8.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 409' ' ' LEU . 2.1 tt -59.47 -33.71 71.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 406' ' ' SER . . . . . . . . . . . . . 30.8 t -76.73 -31.58 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.889 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.4 -35.61 75.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 408' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 405' ' ' LEU . 9.9 mt -69.85 -40.49 78.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.069 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 409' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 405' ' ' LEU . 4.7 mt -75.98 -31.01 58.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.898 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -71.01 -37.9 72.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.35 -39.48 78.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 412' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 61.06 29.73 19.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 136.62 32.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.21 147.23 37.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.561 ' HA ' ' HB3' ' A' ' 418' ' ' ALA . 51.3 Cg_exo -52.86 -23.48 21.05 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.415 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 416' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -54.64 -29.78 53.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.065 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 417' ' ' THR . . . . . . . . . . . . . 9.0 t -130.86 19.75 5.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.297 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' A' ' 415' ' ' PRO . . . -91.13 163.64 14.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.196 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 419' ' ' SER . . . . . . . . . . . . . 3.1 p -80.02 -178.12 6.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.84 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 420' ' ' GLN . . . . . 0.459 ' O ' HG23 ' A' ' 424' ' ' VAL . 6.5 tt0 -69.42 -43.89 72.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 421' ' ' SER . . . . . . . . . . . . . 15.8 m -58.51 -34.15 70.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 422' ' ' LEU . . . . . 0.696 HD13 ' O ' ' A' ' 422' ' ' LEU . 2.9 tm? -71.88 -38.13 70.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 35.8 mt -64.68 -40.4 95.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 420' ' ' GLN . 42.3 t -66.38 -46.12 87.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.05 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -60.52 -41.5 94.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 1.7 mp -70.48 -33.82 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.975 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -60.86 -44.47 96.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.82 76.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.0 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 17.5 ttm -68.05 -43.09 79.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -60.68 -47.97 83.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' PHE . . . . . 0.545 ' HA ' HD12 ' A' ' 435' ' ' LEU . 22.9 t80 -61.43 -41.6 97.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 42.1 mt -73.71 -28.38 61.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.022 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -69.97 -38.85 76.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 432' ' ' PHE . 5.9 mt -60.7 145.27 88.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.059 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.12 164.72 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.574 2.183 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.72 -33.41 75.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.48 81.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.021 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -50.5 41.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.715 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 444' ' ' TYR . 88.2 mtm-85 -57.75 -36.02 71.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.784 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -54.16 49.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.09 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' ARG . . . . . . . . . . . . . 10.0 mtp-105 -58.86 -47.87 83.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' ILE . . . . . 0.523 HD12 ' HE1' ' A' ' 432' ' ' PHE . 56.0 mt -60.27 -28.74 42.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' TYR . . . . . 0.421 ' CE1' ' CD1' ' A' ' 388' ' ' ILE . 9.9 m-85 -72.91 -44.21 61.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -100.05 21.81 12.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.476 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' ASP . . . . . . . . . . . . . 48.8 p-10 -78.95 61.3 3.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 110.99 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -127.63 32.28 5.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.931 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.47 72.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -60.31 -39.73 88.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.39 -33.38 15.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 58.7 m -85.83 57.04 4.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -141.93 96.62 3.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -98.86 27.96 4.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.073 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' ALA . . . . . . . . . . . . . . . -100.0 -49.87 4.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.07 -179.969 . . . . . . . . 0 0 . 1 stop_ save_