data_2mqq_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 2mqq _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo . . . . . 0 N--CA 1.455 -0.77 0 N-CA-C 110.978 -0.432 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -145.4 157.94 43.93 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.917 0.487 . . . . 0.0 110.851 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.75 156.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -76.37 0.88 17.93 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -157.43 146.72 15.0 Favored Pre-proline 0 CA--C 1.53 0.18 0 C-N-CA 122.741 0.417 . . . . 0.0 110.699 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.74 -10.7 29.85 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 123.239 2.626 . . . . 0.0 111.073 173.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.98 155.77 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.617 0.767 . . . . 0.0 112.386 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -137.98 154.4 49.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.333 1.053 . . . . 0.0 109.309 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 82.3 mmm -126.01 142.41 51.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 123.399 0.68 . . . . 0.0 111.836 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -136.24 148.69 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -140.74 174.28 10.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.55 10.11 82.24 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 45.3 mt -80.45 25.96 0.39 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.531 0.732 . . . . 0.0 112.239 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.51 -39.78 94.42 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -67.58 150.62 48.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.122 0.487 . . . . 0.0 111.217 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 87.6 p -69.06 -8.75 48.04 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -77.27 -17.06 58.69 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 117.92 0.327 . . . . 0.0 111.3 -176.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 65.4 mmm -88.29 145.43 25.85 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.943 0.338 . . . . 0.0 110.422 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -160.92 158.32 27.98 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.8 p -60.28 -30.93 69.78 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -174.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -70.4 -41.54 72.85 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 177.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.96 -42.47 48.34 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.52 -174.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -69.37 -43.01 81.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -176.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.28 -30.81 57.94 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.025 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -76.97 -30.77 56.12 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.914 1.234 . . . . 0.0 110.101 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.84 -55.76 21.84 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.559 1.3 p90 -76.51 -4.72 44.19 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 117.679 2.474 . . . . 0.0 117.679 173.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . 0.481 ' HG ' HG11 ' A' ' 406' ' ' VAL . 41.1 t -72.74 -32.36 65.62 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 122.144 -0.347 . . . . 0.0 110.414 176.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.39 -17.19 52.97 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.49 177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -88.5 -4.53 58.59 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.99 176.03 33.65 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-N 118.605 0.639 . . . . 0.0 112.431 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.93 134.22 49.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 122.539 -0.389 . . . . 0.0 111.698 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.481 HG11 ' HG ' ' A' ' 401' ' ' CYS . 1.2 m -114.02 165.47 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 124.614 1.166 . . . . 0.0 113.65 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -121.49 -65.36 1.14 Allowed 'General case' 0 N--CA 1.457 -0.077 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.183 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -154.47 167.02 31.44 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.1 p -138.64 150.24 23.91 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 C-N-CA 124.031 0.933 . . . . 0.0 110.136 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -151.41 125.4 9.2 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.066 0.547 . . . . 0.0 110.988 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -85.3 157.65 20.51 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.3 ptp -136.39 135.64 38.94 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 121.948 0.88 . . . . 0.0 112.487 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -79.13 -5.7 54.77 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 126.061 1.744 . . . . 0.0 112.769 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.8 t -77.76 -4.12 44.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.918 0.326 . . . . 0.0 111.823 -171.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -141.74 157.36 65.02 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 124.159 0.983 . . . . 0.0 109.255 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.42 -11.91 33.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.177 2.585 . . . . 0.0 112.037 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.86 93.3 0.09 OUTLIER Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 175.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.5 162.78 39.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.788 0.435 . . . . 0.0 110.708 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.33 170.87 21.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.963 0.505 . . . . 0.0 110.243 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 21.6 ptm -131.97 152.23 51.24 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.695 0.798 . . . . 0.0 109.181 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.4 t -138.55 150.49 24.05 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.208 0 C-N-CA 123.184 0.594 . . . . 0.0 112.236 -173.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -129.06 131.09 47.27 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 46.0 mtp -152.87 174.89 13.52 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.588 0.755 . . . . 0.0 109.439 -170.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -67.66 115.5 7.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.5 p30 -72.24 -32.6 66.85 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -167.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.94 -86.47 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -74.65 -27.08 60.27 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 117.125 2.268 . . . . 0.0 117.125 -176.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.84 -35.2 17.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.074 -174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.8 t -86.41 -27.21 6.07 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 CA-C-N 119.776 1.171 . . . . 0.0 108.818 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -66.19 -50.79 62.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.036 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -70.35 -30.56 67.55 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.54 -33.92 76.75 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.65 0.659 . . . . 0.0 110.168 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 52.5 mt -80.1 -16.84 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.472 0.709 . . . . 0.0 110.782 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -90.22 -19.71 23.85 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -126.14 -28.53 3.13 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 91.2 mt -134.38 -8.35 2.56 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.54 1.518 . . . . 0.0 114.911 -170.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.546 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.06 2.45 Favored 'General case' 0 C--O 1.202 -1.418 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.573 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 15.4 m-80 79.4 20.75 0.66 Allowed 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 124.281 3.219 . . . . 0.0 114.058 -161.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -75.71 162.99 27.75 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.065 -1.022 . . . . 0.0 110.641 167.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -80.0 140.16 36.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 175.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.1 ttt -160.41 138.4 9.84 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.831 0.852 . . . . 0.0 109.957 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 52.6 m-85 56.99 24.21 9.22 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.59 9.46 86.4 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.661 -0.575 . . . . 0.0 111.661 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -135.18 -168.91 2.27 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.905 1.282 . . . . 0.0 108.716 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -122.0 151.85 40.37 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.653 0.263 . . . . 0.0 111.221 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 10.5 ptm -127.25 75.74 1.61 Allowed 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 124.873 1.269 . . . . 0.0 109.203 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.8 m120 -53.35 128.1 27.19 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 115.482 -2.199 . . . . 0.0 112.266 -173.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.428 2.0 t -126.64 150.87 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.439 -3.304 . . . . 0.0 115.76 168.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -164.74 170.27 15.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.645 1.178 . . . . 0.0 109.71 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.0 t -74.53 145.54 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 45.4 t -86.15 170.04 12.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.55 0.74 . . . . 0.0 111.414 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -115.98 0.72 13.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.554 0.342 . . . . 0.0 110.479 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -76.24 150.15 82.61 Favored Pre-proline 0 CA--C 1.53 0.183 0 C-N-CA 123.685 0.794 . . . . 0.0 110.94 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.91 -38.48 1.22 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.953 2.435 . . . . 0.0 111.522 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.93 159.54 7.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.719 0.808 . . . . 0.0 110.213 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 50.8 mt -78.36 143.94 11.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.077 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 82.1 mtp -120.22 130.37 24.88 Favored Pre-proline 0 CA--C 1.528 0.112 0 CA-C-N 117.622 0.192 . . . . 0.0 111.498 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.34 170.09 20.07 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 124.033 3.155 . . . . 0.0 109.612 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.17 -123.91 1.78 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -72.42 157.89 36.79 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.035 0.534 . . . . 0.0 109.738 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 91.9 p -151.93 174.08 14.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.834 0.454 . . . . 0.0 110.273 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.97 3.25 4.05 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.82 -175.05 54.65 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -176.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 78.7 mt -143.94 166.46 24.9 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.332 1.053 . . . . 0.0 109.328 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.81 -30.42 68.98 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 122.304 -0.248 . . . . 0.0 110.821 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -120.46 13.7 11.84 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -147.41 163.12 28.73 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 -178.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.8 t -86.57 -32.34 20.71 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.66 0.384 . . . . 0.0 111.703 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.5 m -127.1 155.63 43.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.3 0.64 . . . . 0.0 111.296 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.9 p -79.17 3.31 18.09 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.7 0.4 . . . . 0.0 110.778 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -136.04 149.71 48.89 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -152.99 151.83 30.72 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.39 0.276 . . . . 0.0 110.597 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -121.58 137.83 54.57 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -130.89 4.34 4.5 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 94.7 p -66.76 -16.09 64.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.104 0.562 . . . . 0.0 111.997 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -114.08 1.29 14.57 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.117 0.567 . . . . 0.0 111.322 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.5 t -77.96 149.0 34.2 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.785 0.434 . . . . 0.0 111.483 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -81.69 -8.02 59.66 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.737 0.415 . . . . 0.0 110.87 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . 0.445 HD22 ' CD2' ' A' ' 561' ' ' HIS . 6.5 m-20 -62.38 -21.58 65.46 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 122.386 0.274 . . . . 0.0 111.695 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -61.91 112.77 2.45 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -30.05 59.94 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.286 66.6 m-85 -97.98 11.94 35.84 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 179.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -74.53 -13.83 60.73 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -134.58 149.27 70.45 Favored Pre-proline 0 C--N 1.338 0.102 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.78 -24.73 21.08 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 123.211 2.607 . . . . 0.0 111.797 -177.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -76.84 -16.78 59.33 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.232 0.469 . . . . 0.0 110.584 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 63.1 mm-40 -92.53 -45.71 7.98 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 173.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.13 -18.69 61.6 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.798 0.439 . . . . 0.0 112.177 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.12 -22.79 44.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -124.09 -0.66 8.34 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -61.4 156.8 18.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.377 0.535 . . . . 0.0 111.143 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -150.85 139.75 20.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.4 mm -140.61 138.18 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.725 0.81 . . . . 0.0 109.293 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -150.21 173.37 14.01 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.625 0.77 . . . . 0.0 110.052 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -60.51 152.86 63.91 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 122.926 0.49 . . . . 0.0 109.908 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.61 159.34 51.38 Favored 'Trans proline' 0 N--CA 1.449 -1.124 0 C-N-CA 123.209 2.606 . . . . 0.0 110.352 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 93.9 p -156.59 177.52 11.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -83.75 -2.67 56.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.03 143.41 11.26 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 123.756 0.822 . . . . 0.0 112.376 175.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.32 149.61 47.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -120.41 151.39 39.36 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.517 0.727 . . . . 0.0 109.199 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -144.0 159.32 42.8 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.41 0.624 . . . . 0.0 112.018 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -149.17 167.76 25.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 102.99 -2.967 . . . . 0.0 102.99 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 56.68 57.49 4.74 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 122.226 -0.296 . . . . 0.0 111.182 -174.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -128.91 152.07 78.5 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.859 0.464 . . . . 0.0 110.597 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.78 154.51 31.48 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.515 2.81 . . . . 0.0 113.132 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.4 -16.48 63.93 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.494 0.718 . . . . 0.0 111.66 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -122.95 24.75 8.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.441 0.696 . . . . 0.0 110.835 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.03 -9.56 10.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -175.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.57 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.73 -177.32 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -165.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.57 ' H ' HG21 ' A' ' 510' ' ' THR . 23.2 pt-20 -28.64 -35.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.8 mt-10 -58.87 -46.3 88.14 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 116.915 -1.517 . . . . 0.0 114.553 170.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -87.66 -27.6 22.36 Favored 'General case' 0 C--N 1.354 0.792 0 CA-C-N 122.826 2.557 . . . . 0.0 106.861 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -66.65 -32.45 73.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.65 -46.26 39.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -76.44 -24.4 53.92 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.626 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.6 mt -74.91 -44.38 45.04 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 118.588 0.631 . . . . 0.0 110.203 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 86.4 m -66.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.53 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -69.54 -24.02 63.66 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -77.47 -30.89 53.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.266 0.227 . . . . 0.0 110.668 175.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 94.0 mt -86.17 -3.66 59.01 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.028 0.531 . . . . 0.0 111.141 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.04 -3.11 62.59 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 123.35 0.5 . . . . 0.0 112.377 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.8 t -77.36 148.47 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 CA-C-N 117.696 0.748 . . . . 0.0 111.825 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.94 133.97 51.99 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -75.37 152.67 85.82 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.727 0.411 . . . . 0.0 110.03 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -65.06 153.18 79.53 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.335 2.69 . . . . 0.0 111.579 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -83.88 -14.75 50.35 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 33.5 t -152.36 153.8 34.35 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 122.478 0.311 . . . . 0.0 110.321 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 60.9 t -145.81 145.94 19.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.44 0.696 . . . . 0.0 110.958 -175.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -146.45 145.23 30.15 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.645 0.778 . . . . 0.0 109.461 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 10.7 t -143.52 144.21 23.62 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.72 -173.08 4.44 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.9 p -139.05 -179.24 5.73 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.95 0.9 . . . . 0.0 110.157 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.37 -9.62 67.14 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 123.74 0.686 . . . . 0.0 112.232 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -88.51 -26.26 22.13 Favored 'General case' 0 C--N 1.338 0.109 0 CA-C-N 117.816 0.808 . . . . 0.0 110.281 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.4 t -165.62 152.66 10.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.908 0.883 . . . . 0.0 109.441 177.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -97.12 -6.02 35.96 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.526 0.33 . . . . 0.0 110.49 175.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.83 -26.64 16.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.177 0.591 . . . . 0.0 111.509 -176.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 25.9 t -159.66 161.8 35.03 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.143 0.429 . . . . 0.0 111.261 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 22.9 t -88.4 170.94 10.5 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.833 0.853 . . . . 0.0 111.932 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.4 t -152.49 160.01 43.28 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.636 1.175 . . . . 0.0 109.204 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.38 -173.49 46.22 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.351 -0.452 . . . . 0.0 112.643 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.51 160.22 26.06 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.584 0.754 . . . . 0.0 110.728 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.2 mt -139.12 162.65 34.43 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 125.265 1.426 . . . . 0.0 108.907 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -152.55 146.85 25.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 122.284 -0.26 . . . . 0.0 111.144 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.5 m-90 -122.72 171.81 8.89 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.788 1.235 . . . . 0.0 112.526 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -77.48 -7.77 56.72 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.915 0.486 . . . . 0.0 111.134 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 38.6 t -155.47 159.58 39.9 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.639 -0.663 . . . . 0.0 111.402 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.52 -34.19 73.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.818 0.447 . . . . 0.0 110.521 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 73.5 m -75.55 -23.83 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.093 0.157 . . . . 0.0 110.785 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -71.79 -35.93 70.15 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.69 -28.75 60.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.525 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.42 -38.77 55.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.697 0.399 . . . . 0.0 111.561 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -72.31 -36.2 68.84 Favored 'General case' 0 C--O 1.233 0.187 0 O-C-N 121.697 -0.627 . . . . 0.0 109.51 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.27 -20.48 63.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.9 -40.18 79.29 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 173.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.32 -39.35 95.86 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 119.792 -0.449 . . . . 0.0 111.984 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.26 6.6 m-85 -88.52 -16.41 32.73 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -115.01 -9.07 12.43 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -72.4 147.55 46.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.783 1.174 . . . . 0.0 109.588 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.445 ' CD2' HD22 ' A' ' 479' ' ' ASN . 1.9 t-80 57.24 17.53 3.67 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 37.0 t80 -70.1 138.75 52.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 178.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.98 133.74 41.63 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.076 -0.39 . . . . 0.0 111.875 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.6 mtm -83.68 152.43 24.75 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.626 0.371 . . . . 0.0 111.156 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 172.223 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.5 p90 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -72.0 161.54 44.52 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.488 2.792 . . . . 0.0 111.297 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.89 142.38 50.67 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 102.545 -3.132 . . . . 0.0 102.545 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.256 0.7 OUTLIER -80.28 139.76 36.51 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.9 tt -84.47 152.17 24.14 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.414 1.085 . . . . 0.0 108.873 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.542 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -137.17 149.28 47.15 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 122.154 -0.341 . . . . 0.0 110.344 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.8 pp -153.95 162.63 41.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.106 0.479 . . . . 0.0 111.255 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 15.1 p -166.64 172.1 10.97 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.825 0.85 . . . . 0.0 110.75 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -56.14 127.23 29.63 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 33.2 t -81.97 148.89 28.45 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.259 1.0 OUTLIER -110.99 10.44 22.18 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 169.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.59 167.44 18.52 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.115 0.966 . . . . 0.0 111.491 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -93.99 -3.22 51.86 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -171.37 177.98 3.38 Favored 'General case' 0 C--N 1.338 0.101 0 C-N-CA 123.555 0.742 . . . . 0.0 110.16 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -134.92 21.33 3.51 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.812 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 178.137 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 N--CA 1.454 -0.803 0 N-CA-C 111.005 -0.421 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -154.85 158.9 40.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.94 165.11 23.85 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.074 0.55 . . . . 0.0 111.346 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -75.48 -7.28 53.72 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.9 t -157.65 147.95 15.81 Favored Pre-proline 0 CA--C 1.531 0.219 0 O-C-N 122.149 -0.345 . . . . 0.0 111.196 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.39 -13.81 22.22 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 124.028 3.152 . . . . 0.0 111.909 172.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.4 t -100.38 151.47 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.558 0.743 . . . . 0.0 112.785 -177.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -130.7 153.75 48.66 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.396 1.478 . . . . 0.0 108.32 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -137.9 128.59 26.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.108 0.413 . . . . 0.0 111.018 -175.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.86 153.57 27.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -142.56 173.5 11.48 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.33 9.72 78.93 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.22 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.2 mt -77.29 28.27 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.463 0.705 . . . . 0.0 111.849 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.65 -27.65 68.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . 0.425 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -77.83 149.96 34.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 121.288 0.566 . . . . 0.0 111.16 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 48.2 t -68.46 -14.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.309 0.643 . . . . 0.0 112.635 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.3 -17.32 63.72 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 46.5 mmm -85.75 148.2 25.97 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 118.53 0.604 . . . . 0.0 110.866 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.79 158.71 28.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.378 0.671 . . . . 0.0 109.259 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 99.5 m -54.3 -40.6 68.06 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 122.322 0.249 . . . . 0.0 110.809 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.69 -38.69 77.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -75.95 -46.0 32.08 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.26 -40.64 80.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.417 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 2.4 t80 -76.15 -31.25 58.47 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -170.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.97 -28.44 55.14 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.714 1.143 . . . . 0.0 110.227 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.1 t -58.24 -57.79 9.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.566 1.7 p90 -76.56 -4.92 45.39 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 118.175 2.658 . . . . 0.0 118.175 173.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.85 -35.01 64.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.764 -0.585 . . . . 0.0 111.24 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.92 -12.41 11.1 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -87.92 -8.99 54.99 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 117.21 2.3 . . . . 0.0 117.21 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 176.87 -148.71 9.12 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.434 0.561 . . . . 0.0 112.733 -176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -107.12 130.43 54.69 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.102 0.561 . . . . 0.0 110.49 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.417 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.1 m -114.11 165.57 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -177.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -129.06 -53.71 1.2 Allowed 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -152.11 165.38 34.94 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.195 0.907 . . . . 0.0 113.045 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.87 147.04 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 124.6 1.16 . . . . 0.0 109.085 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -152.26 116.23 4.89 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.125 0.57 . . . . 0.0 111.376 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.86 158.08 29.6 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 115.821 1.786 . . . . 0.0 115.821 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -114.8 120.95 41.77 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.842 0.457 . . . . 0.0 112.123 -176.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -79.31 -13.06 59.89 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.9 0.48 . . . . 0.0 111.475 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 96.0 p -82.34 1.44 37.06 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.251 0.62 . . . . 0.0 111.895 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -139.81 157.15 70.3 Favored Pre-proline 0 C--N 1.34 0.153 0 C-N-CA 124.311 1.044 . . . . 0.0 109.306 -177.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -68.08 -16.91 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.97 2.446 . . . . 0.0 111.343 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.79 100.65 0.14 Allowed Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.58 158.86 34.72 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.531 0.733 . . . . 0.0 109.633 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -159.64 148.29 17.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.109 0.481 . . . . 0.0 112.078 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.4 mtp -94.34 154.53 17.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.14 0.976 . . . . 0.0 108.99 170.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -145.38 151.43 15.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -134.33 135.64 42.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 8.0 ptp -166.04 174.61 9.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.611 0.764 . . . . 0.0 110.138 -173.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.84 120.47 11.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -72.39 -33.39 67.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -168.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.76 -86.61 0.02 OUTLIER Glycine 0 C--N 1.335 0.495 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -71.59 -30.89 66.34 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -85.37 -36.4 20.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 119.259 -0.976 . . . . 0.0 112.403 -174.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -84.45 -28.3 6.95 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 C-N-CA 118.808 -1.157 . . . . 0.0 110.049 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.86 -46.7 67.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.79 175.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -39.03 89.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.246 -0.284 . . . . 0.0 110.941 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.43 91.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.795 -0.566 . . . . 0.0 110.29 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 59.9 mt -78.47 -8.77 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.283 0.633 . . . . 0.0 111.209 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 54.4 m -102.22 -18.22 15.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -127.48 -29.56 2.67 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -169.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 89.4 mt -134.67 -11.08 2.38 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.467 1.485 . . . . 0.0 114.368 -172.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.546 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.71 101.0 2.45 Favored 'General case' 0 C--O 1.205 -1.272 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -168.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.593 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 14.8 m-80 76.88 21.72 1.15 Allowed 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 123.333 2.788 . . . . 0.0 113.741 -161.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.07 162.23 17.7 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.258 58.0 m-85 -76.96 138.68 39.81 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -158.74 137.46 11.09 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.448 0.699 . . . . 0.0 109.484 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.1 m-85 57.23 25.34 10.93 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 117.266 2.321 . . . . 0.0 117.266 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.3 9.59 86.88 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 -177.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -135.81 -164.16 1.5 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.057 1.343 . . . . 0.0 108.52 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -129.06 146.65 50.97 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.108 -0.37 . . . . 0.0 111.281 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptm -118.96 75.14 1.01 Allowed 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.947 0.899 . . . . 0.0 109.442 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.593 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.4 m120 -53.0 125.23 16.53 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 116.272 -1.823 . . . . 0.0 112.192 -173.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.424 2.0 t -128.74 150.6 34.55 Favored 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 113.455 -3.298 . . . . 0.0 116.434 169.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.1 t -159.61 172.25 18.14 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.212 1.405 . . . . 0.0 107.807 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.5 p -72.3 147.28 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 18.9 t -82.51 156.65 23.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -96.6 -12.4 24.01 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.001 0.121 . . . . 0.0 110.954 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -83.75 153.45 64.33 Favored Pre-proline 0 N--CA 1.454 -0.252 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.03 -34.52 2.18 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.335 2.69 . . . . 0.0 112.306 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.52 159.04 11.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.177 0.444 . . . . 0.0 111.695 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 87.7 mt -83.72 150.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 173.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 62.0 mtm -125.5 130.24 24.16 Favored Pre-proline 0 CA--C 1.53 0.178 0 O-C-N 122.312 -0.243 . . . . 0.0 111.213 173.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.7 165.36 26.95 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.933 3.089 . . . . 0.0 110.87 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 147.62 -108.73 0.44 Allowed Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 177.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -72.51 162.43 29.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 120.837 0.351 . . . . 0.0 110.278 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.9 p -161.27 177.04 10.57 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.914 0.486 . . . . 0.0 110.321 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -144.46 163.44 33.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.96 162.62 54.39 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 121.11 0.283 . . . . 0.0 113.077 -174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.88 171.27 10.86 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.017 0.927 . . . . 0.0 109.94 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -69.33 -26.89 64.93 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.293 -0.254 . . . . 0.0 111.061 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -120.17 11.7 11.67 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.34 -171.6 28.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.801 -0.52 . . . . 0.0 111.801 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 70.2 m -124.91 -7.91 7.23 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -177.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.2 t -127.07 138.95 53.3 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 85.3 p -85.31 9.1 16.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.874 0.87 . . . . 0.0 111.627 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -138.24 151.61 47.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.09 146.51 25.58 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.691 0.396 . . . . 0.0 110.1 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -112.25 139.98 47.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -126.0 4.59 7.24 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 45.7 t -65.81 -20.64 66.32 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.915 0.486 . . . . 0.0 111.499 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -113.86 1.48 14.78 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.51 . . . . 0.0 111.423 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 42.3 t -77.67 147.28 35.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.894 0.378 . . . . 0.0 111.334 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.21 -8.32 48.86 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.816 0.447 . . . . 0.0 110.926 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -61.88 -20.03 63.29 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 122.76 0.424 . . . . 0.0 112.052 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -58.74 115.36 3.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.235 0.614 . . . . 0.0 109.627 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -74.78 -33.43 62.26 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -172.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -95.25 16.04 17.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.3 p -70.99 -10.9 60.55 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.4 149.94 67.08 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.94 -25.32 59.7 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.989 2.459 . . . . 0.0 111.614 176.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -75.49 -28.31 59.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.363 0.265 . . . . 0.0 110.698 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -81.97 -46.11 14.45 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.96 -16.97 61.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -78.19 -19.77 53.23 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.443 0.297 . . . . 0.0 111.785 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.04 -2.93 8.13 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.12 159.64 22.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.498 0.59 . . . . 0.0 110.317 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -151.79 145.94 25.35 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.3 mm -140.53 139.83 34.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.747 0.819 . . . . 0.0 109.356 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -150.11 166.38 29.96 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.179 0.991 . . . . 0.0 109.661 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.51 138.84 97.48 Favored Pre-proline 0 C--O 1.233 0.203 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.36 151.07 81.91 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.463 2.775 . . . . 0.0 111.339 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 83.1 p -148.42 -173.73 4.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.303 -175.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -83.74 4.72 27.61 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.813 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.15 137.97 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 73.3 mt -124.5 155.58 38.72 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.989 0.515 . . . . 0.0 109.782 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -121.75 144.44 48.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.352 1.061 . . . . 0.0 108.265 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -136.65 159.25 42.38 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.457 0.646 . . . . 0.0 110.688 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -152.27 168.45 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 103.722 -2.695 . . . . 0.0 103.722 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 57.61 57.49 4.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.678 0.391 . . . . 0.0 111.486 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -142.23 119.46 7.25 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 122.392 -0.193 . . . . 0.0 111.176 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.04 161.75 3.18 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 124.417 3.411 . . . . 0.0 113.219 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.52 -16.41 63.87 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.275 0.63 . . . . 0.0 111.914 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -94.07 -1.99 53.54 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.5 m -78.93 -11.5 13.15 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.499 ' O ' ' N ' ' A' ' 512' ' ' GLU . 1.9 m -55.25 179.07 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.226 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -168.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.455 ' H ' HG23 ' A' ' 510' ' ' THR . 89.0 tt0 12.09 -68.8 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.851 2.061 . . . . 0.0 114.189 175.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 510' ' ' THR . 95.8 mt-10 -54.36 -48.14 71.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -88.0 -23.57 23.77 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 121.941 2.155 . . . . 0.0 106.014 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -62.13 -40.8 97.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 118.259 -1.376 . . . . 0.0 113.468 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -72.61 -44.07 62.46 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -77.38 -18.9 56.93 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.491 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.5 mt -75.51 -39.16 40.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.116 0 CA-C-N 118.486 0.585 . . . . 0.0 109.509 173.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.8 -38.69 89.64 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.769 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -68.7 -29.36 67.78 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -75.08 -26.52 59.39 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.392 0.277 . . . . 0.0 110.775 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.72 -2.16 44.99 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 111.326 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.86 -0.7 61.22 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 123.295 0.474 . . . . 0.0 113.104 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.0 151.16 5.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.893 0.847 . . . . 0.0 112.206 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.42 149.84 49.72 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.937 0.398 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.94 152.92 91.02 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 123.112 0.565 . . . . 0.0 111.226 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.57 157.59 60.21 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.631 2.887 . . . . 0.0 110.529 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -89.22 -17.14 29.66 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.7 t -155.21 159.13 39.87 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.613 0.244 . . . . 0.0 111.421 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 62.6 t -143.13 144.93 23.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 C-N-CA 124.449 1.1 . . . . 0.0 110.09 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -148.18 140.97 24.66 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.18 143.74 29.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -154.89 -171.77 3.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.8 t -141.44 -172.15 3.46 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.765 0.826 . . . . 0.0 109.91 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 100.46 11.22 42.19 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 123.526 0.584 . . . . 0.0 112.373 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -126.95 -17.32 4.91 Favored 'General case' 0 C--N 1.339 0.148 0 CA-C-N 117.762 0.781 . . . . 0.0 112.593 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -163.56 152.96 14.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 117.876 0.307 . . . . 0.0 110.774 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.93 -8.09 31.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.921 0.489 . . . . 0.0 110.63 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -79.38 -41.85 26.86 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.254 0.622 . . . . 0.0 111.684 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.5 p -164.05 173.59 12.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 110.814 -173.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 45.5 p -83.44 177.74 8.33 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.547 0.689 . . . . 0.0 111.066 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.6 p -150.57 163.06 39.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.75 -169.67 42.65 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.827 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.33 160.28 23.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.448 0.699 . . . . 0.0 110.479 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.9 mt -139.27 157.96 44.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.858 1.263 . . . . 0.0 108.091 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -148.12 149.23 31.65 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.093 0.406 . . . . 0.0 111.995 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -127.12 175.06 8.41 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.351 1.461 . . . . 0.0 112.39 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -76.52 -12.3 60.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.609 0.364 . . . . 0.0 110.999 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.5 t -158.32 160.52 37.08 Favored 'General case' 0 C--O 1.232 0.163 0 O-C-N 121.808 -0.557 . . . . 0.0 110.851 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -75.15 -21.54 58.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.02 -0.425 . . . . 0.0 110.935 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.4 m -77.25 -25.67 51.73 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.019 0.372 . . . . 0.0 110.065 174.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -74.72 -34.05 62.51 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.245 0.618 . . . . 0.0 111.896 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.35 -28.96 57.03 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.386 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.5 tp -72.74 -39.25 67.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.734 0.243 . . . . 0.0 111.284 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -73.39 -39.03 65.41 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -26.27 62.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 176.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -68.11 -37.73 81.49 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 172.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.94 -30.05 75.51 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.559 -0.578 . . . . 0.0 112.325 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 7.5 m-85 -98.69 -8.25 26.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 118.924 2.935 . . . . 0.0 118.924 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.36 -8.69 10.51 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -72.05 145.36 48.31 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.354 0.979 . . . . 0.0 108.923 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.64 21.84 9.2 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.571 0.748 . . . . 0.0 112.326 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -61.54 134.24 56.62 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -81.11 121.21 25.82 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.047 -0.408 . . . . 0.0 110.732 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.8 152.61 18.33 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? . . . . . 0 C--O 1.233 0.2 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 169.364 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 6.6 p90 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.51 168.85 14.28 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.689 2.926 . . . . 0.0 111.486 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -129.82 142.37 50.69 Favored 'General case' 0 N--CA 1.457 -0.109 0 N-CA-C 103.049 -2.945 . . . . 0.0 103.049 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.251 1.0 OUTLIER -81.67 131.3 35.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -178.053 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -78.5 149.29 33.17 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.542 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -137.03 147.25 46.09 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.566 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.92 159.84 38.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.647 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 20.4 p -160.81 174.74 13.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.024 0.929 . . . . 0.0 110.144 -177.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -58.09 124.45 19.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.3 t -79.76 149.52 31.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -171.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.266 0.8 OUTLIER -111.38 9.97 21.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 169.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.82 164.42 19.66 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.231 1.012 . . . . 0.0 111.863 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -92.83 -3.07 55.3 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.709 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -170.6 177.0 4.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.746 0.818 . . . . 0.0 110.074 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.41 28.33 1.2 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.072 0.549 . . . . 0.0 111.64 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 117.426 -1.273 . . . . 0.0 111.154 -177.797 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.456 -0.687 0 CA-C-O 120.974 0.323 . . . . 0.0 112.821 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -148.59 152.3 36.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.915 0.486 . . . . 0.0 110.728 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.72 26.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.066 0.547 . . . . 0.0 110.882 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -82.81 -0.93 50.23 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.1 t -156.96 144.77 14.08 Favored Pre-proline 0 C--O 1.232 0.151 0 C-N-CA 122.804 0.442 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.7 -15.29 33.56 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.209 2.606 . . . . 0.0 110.836 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.01 150.91 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.1 153.03 42.49 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.933 0.893 . . . . 0.0 109.707 -175.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 97.0 mmm -120.32 147.59 44.82 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 123.55 0.74 . . . . 0.0 111.39 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 5.9 p -139.65 146.2 25.67 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -143.21 173.71 11.35 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . 0.429 ' C ' ' H ' ' A' ' 387' ' ' ASP . . . 89.18 13.56 61.75 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.673 -0.571 . . . . 0.0 111.673 -179.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 20.7 mt -75.73 32.32 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.881 0.872 . . . . 0.0 111.481 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 385' ' ' GLY . 61.3 m-20 -71.08 14.29 0.16 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -137.12 149.57 47.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.126 0.571 . . . . 0.0 110.811 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 39.3 t -69.53 -13.63 62.43 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.495 0.718 . . . . 0.0 112.057 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -67.77 -20.61 65.24 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 122.676 0.39 . . . . 0.0 111.875 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 67.4 mtp -94.28 148.57 22.08 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.069 -0.394 . . . . 0.0 110.615 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.78 154.39 28.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.3 p -59.17 -30.69 68.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -176.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -70.09 -43.23 71.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -76.03 -42.1 48.84 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 41.4 t -69.32 -42.31 81.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -76.29 -29.99 57.59 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.805 -0.616 . . . . 0.0 111.19 -171.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -75.95 -31.04 58.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.344 0.975 . . . . 0.0 109.857 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.97 -55.63 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.55 1.8 p90 -76.59 -4.86 45.12 Favored 'General case' 0 C--N 1.339 0.147 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . 0.511 ' HG ' ' CG1' ' A' ' 406' ' ' VAL . 41.8 t -72.39 -34.31 67.82 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 122.008 -0.432 . . . . 0.0 110.867 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.52 -14.46 19.88 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.096 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.33 -3.48 58.46 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.6 -174.83 43.29 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 119.193 0.906 . . . . 0.0 113.262 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -76.34 130.12 37.62 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.511 ' CG1' ' HG ' ' A' ' 401' ' ' CYS . 1.2 m -114.11 165.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -129.93 -61.3 1.0 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 176.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -148.39 165.13 32.02 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -170.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.37 145.01 21.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 124.774 1.23 . . . . 0.0 108.485 171.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -153.7 121.49 5.98 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -76.98 166.93 22.66 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.8 ptp -142.82 138.0 30.04 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 118.879 0.763 . . . . 0.0 112.714 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -5.56 53.98 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.706 1.202 . . . . 0.0 112.156 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.0 t -78.06 -4.97 49.9 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.214 0.605 . . . . 0.0 111.646 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.49 155.57 67.15 Favored Pre-proline 0 CA--C 1.53 0.184 0 C-N-CA 123.993 0.917 . . . . 0.0 109.918 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 -13.75 38.14 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.392 2.728 . . . . 0.0 111.894 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.43 87.27 0.07 OUTLIER Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -152.48 160.44 43.25 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.963 0.505 . . . . 0.0 110.838 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.61 170.43 22.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.663 0.385 . . . . 0.0 110.434 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 22.1 mtm -123.97 157.34 34.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.034 0.934 . . . . 0.0 108.828 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -142.0 152.03 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.756 0.822 . . . . 0.0 110.38 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.73 132.87 42.78 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtp -155.13 172.39 18.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -171.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.08 127.05 30.6 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 170.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -73.07 -34.76 66.43 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -168.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.11 -89.1 0.01 OUTLIER Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -72.78 -26.54 61.57 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.7 -36.43 17.4 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 118.838 -1.145 . . . . 0.0 111.668 -174.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.79 -27.31 6.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.205 0 C-N-CA 118.553 -1.259 . . . . 0.0 109.374 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -68.77 -53.39 22.05 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.108 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 25.6 mtm180 -68.9 -29.99 68.39 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.05 78.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.094 -0.643 . . . . 0.0 110.011 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.72 -9.97 12.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.303 0.641 . . . . 0.0 111.084 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 29.9 m -96.77 -21.33 17.61 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -125.79 -26.9 3.41 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -169.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 88.1 mt -134.59 -8.75 2.48 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.906 1.684 . . . . 0.0 114.624 -172.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.567 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.2 p-10 -71.63 101.09 2.43 Favored 'General case' 0 C--O 1.207 -1.157 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -168.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.565 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 16.3 m-80 77.47 22.02 0.97 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 123.98 3.082 . . . . 0.0 114.054 -160.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -76.87 163.06 27.12 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.906 -1.121 . . . . 0.0 110.207 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -68.71 136.61 53.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 173.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.9 ttt -158.43 142.26 15.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.478 ' CE1' ' HG3' ' A' ' 554' ' ' GLU 0.273 53.2 m-85 59.92 15.63 5.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.16 9.17 70.74 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -136.03 -171.14 2.8 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.497 1.119 . . . . 0.0 108.439 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -128.43 136.2 50.54 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.088 -0.383 . . . . 0.0 110.795 178.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -94.82 -152.51 0.36 Allowed 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.565 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 31.4 t-20 -159.22 129.28 5.69 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 115.903 -1.999 . . . . 0.0 110.521 175.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.567 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.459 2.1 t -124.03 145.25 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 112.864 -3.534 . . . . 0.0 115.147 167.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -161.29 164.76 29.99 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.869 0.868 . . . . 0.0 109.442 -176.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.4 p -75.29 150.69 6.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 37.0 t -93.29 158.09 15.92 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.726 0.81 . . . . 0.0 111.997 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -96.85 -7.88 32.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.667 0.387 . . . . 0.0 110.552 175.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -71.01 147.52 93.9 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.494 0.717 . . . . 0.0 110.526 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.9 -32.91 2.39 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.195 2.597 . . . . 0.0 111.435 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.77 158.87 9.34 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.544 0.738 . . . . 0.0 110.395 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 67.5 mt -82.89 133.42 29.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 34.2 mmm -98.0 129.32 31.3 Favored Pre-proline 0 N--CA 1.454 -0.274 0 C-N-CA 122.374 0.27 . . . . 0.0 111.241 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.32 161.95 37.04 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.437 2.758 . . . . 0.0 109.024 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 151.76 -129.52 2.85 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 121.128 -0.558 . . . . 0.0 111.899 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -72.32 171.3 12.43 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.267 0.627 . . . . 0.0 111.149 -177.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.6 p -156.01 170.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.538 0.735 . . . . 0.0 109.403 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -128.75 5.88 5.55 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.39 -170.95 55.16 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.215 -0.303 . . . . 0.0 112.499 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.3 mt -143.01 168.35 19.91 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.081 0.952 . . . . 0.0 109.592 -178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -75.22 -24.34 57.71 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 122.364 -0.21 . . . . 0.0 110.45 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -120.61 20.27 11.8 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.618 0.767 . . . . 0.0 110.825 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.33 167.32 36.86 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.604 -0.685 . . . . 0.0 112.289 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 t -93.66 -26.67 16.95 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.73 0.412 . . . . 0.0 112.111 -176.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.7 t -127.02 148.03 50.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.986 0.515 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.4 p -90.17 7.94 35.48 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.394 0.678 . . . . 0.0 111.418 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -134.34 145.82 49.37 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -156.57 151.73 26.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.888 0.375 . . . . 0.0 110.663 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.1 130.32 41.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.587 0.755 . . . . 0.0 112.25 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.54 -12.03 41.12 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 117.542 2.423 . . . . 0.0 117.542 -173.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 43.9 t -68.93 -29.93 68.27 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.641 0.257 . . . . 0.0 110.357 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -80.0 -18.38 50.4 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.699 0.399 . . . . 0.0 111.117 177.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.2 m -93.87 -4.0 50.78 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.873 0.469 . . . . 0.0 112.056 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.66 3.96 0.96 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.311 1.044 . . . . 0.0 112.83 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -59.61 -17.64 34.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -57.05 122.27 11.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.247 0.619 . . . . 0.0 110.625 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -81.05 -33.66 33.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.304 64.7 m-85 -98.0 10.46 40.29 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 117.376 2.362 . . . . 0.0 117.376 -178.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 86.5 p -71.79 -10.72 60.19 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' THR . . . . . 0.42 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -135.96 148.98 67.19 Favored Pre-proline 0 C--O 1.232 0.136 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 179.623 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.47 -24.63 63.64 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 123.237 2.625 . . . . 0.0 111.554 176.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -73.97 -27.5 61.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.344 0.257 . . . . 0.0 110.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -88.44 -43.17 11.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 175.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.39 63.79 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.48 -18.61 44.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -124.06 -4.9 7.94 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -62.93 158.97 17.85 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.105 0.411 . . . . 0.0 110.752 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -150.03 144.91 26.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.5 mm -136.29 153.03 30.69 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 C-N-CA 123.891 0.876 . . . . 0.0 108.724 -175.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -155.01 162.26 41.13 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -57.28 153.01 28.54 Favored Pre-proline 0 CA--C 1.531 0.225 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -63.81 143.41 86.06 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.923 2.416 . . . . 0.0 109.644 -177.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.4 t -153.63 171.93 18.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.774 0.43 . . . . 0.0 110.205 -173.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -83.73 2.31 38.48 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.265 -0.272 . . . . 0.0 110.877 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.39 137.81 24.82 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 71.0 mt -125.39 156.09 39.34 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.081 0.553 . . . . 0.0 109.691 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -125.09 132.79 53.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -120.96 160.59 23.21 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 111.505 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -147.79 153.6 39.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 28.0 m120 55.52 57.47 5.32 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.072 -175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -113.6 153.06 45.9 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 122.897 0.479 . . . . 0.0 110.205 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -57.7 153.63 41.84 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.493 2.795 . . . . 0.0 112.696 -177.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.65 -16.3 63.79 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.381 0.672 . . . . 0.0 112.059 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -122.95 25.0 8.77 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.484 0.714 . . . . 0.0 110.95 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.61 -9.35 10.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 512' ' ' GLU . 0.2 OUTLIER -54.88 -177.29 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 117.214 -1.374 . . . . 0.0 114.222 -165.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.508 ' H ' HG21 ' A' ' 510' ' ' THR . 8.8 pm0 -30.86 -33.55 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.397 1.453 . . . . 0.0 114.77 -167.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.0 mt-10 -60.3 -45.64 92.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 117.047 -1.454 . . . . 0.0 114.723 170.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -87.53 -30.03 20.89 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 122.745 2.52 . . . . 0.0 106.528 -173.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -62.44 -33.81 75.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -76.15 -42.71 45.8 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -79.84 -19.27 48.77 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.659 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.2 -44.87 42.75 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 118.698 0.681 . . . . 0.0 110.081 175.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.6 m -64.19 -33.93 76.91 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.902 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -67.28 -37.39 83.35 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.013 0.435 . . . . 0.0 112.01 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -74.46 -30.71 61.98 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.707 0.403 . . . . 0.0 111.124 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.35 -4.61 58.99 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.649 0.379 . . . . 0.0 111.926 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 71.95 33.6 62.58 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.62 159.63 42.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.57 0.748 . . . . 0.0 112.889 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.08 149.09 50.83 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.138 0.575 . . . . 0.0 111.736 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -91.13 157.13 43.33 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.572 0.749 . . . . 0.0 111.023 -178.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -68.23 160.83 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.575 2.85 . . . . 0.0 111.196 174.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -97.87 -18.6 18.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 38.1 m -148.49 156.34 42.33 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.671 . . . . 0.0 110.959 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 59.7 t -143.98 148.22 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.543 0.737 . . . . 0.0 110.863 -175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -147.35 142.36 27.02 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 123.804 0.842 . . . . 0.0 108.884 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -140.51 142.82 30.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 122.99 0.516 . . . . 0.0 112.282 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -156.09 -175.61 5.52 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -178.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.2 p -142.71 -169.09 2.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.465 1.106 . . . . 0.0 109.336 178.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.43 8.85 62.25 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.698 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . 0.578 ' HZ3' ' HB3' ' A' ' 535' ' ' LYS . 0.4 OUTLIER -140.02 9.62 2.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 117.699 0.749 . . . . 0.0 111.371 179.022 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 42.5 t -158.63 157.62 32.24 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.765 0.826 . . . . 0.0 109.543 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -116.96 -5.34 11.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.996 0.518 . . . . 0.0 111.037 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -89.91 -50.17 6.19 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 122.843 0.457 . . . . 0.0 112.205 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 80.6 p -165.53 179.0 6.35 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 122.77 0.428 . . . . 0.0 110.94 -177.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 74.3 m -70.22 168.95 14.69 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.8 t -147.07 163.96 34.58 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.58 1.552 . . . . 0.0 108.398 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.12 -171.92 44.92 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.126 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.82 160.31 22.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.8 0.84 . . . . 0.0 110.484 -177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.3 mt -140.66 158.16 44.38 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.647 1.179 . . . . 0.0 108.936 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -148.72 152.21 36.23 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 117.607 0.185 . . . . 0.0 111.228 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.4 m-90 -128.42 167.84 16.45 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.869 1.268 . . . . 0.0 112.785 -177.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -70.53 -8.32 50.42 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -158.44 161.22 37.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.51 0.324 . . . . 0.0 110.932 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -66.13 -34.83 78.94 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.906 0.482 . . . . 0.0 110.219 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.9 p -78.35 -25.82 46.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.425 0.29 . . . . 0.0 110.893 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -68.79 -35.34 76.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.39 65.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 48.0 tp -65.51 -40.06 92.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.613 0.244 . . . . 0.0 110.585 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . 0.478 ' HG3' ' CE1' ' A' ' 442' ' ' PHE . 39.8 tt0 -64.27 -47.93 77.67 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.479 0.657 . . . . 0.0 110.712 177.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.86 -19.2 61.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.62 -44.29 82.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 173.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.9 -45.69 96.03 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.284 19.0 m-85 -76.86 -32.02 57.22 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 119.103 3.001 . . . . 0.0 119.103 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 57.8 mt -90.73 -19.29 23.71 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 119.504 1.047 . . . . 0.0 112.933 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -73.99 145.34 44.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.131 0.878 . . . . 0.0 110.118 -178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 57.54 12.62 1.58 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.431 1.093 . . . . 0.0 113.091 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 40.1 t80 -72.9 138.83 46.45 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -71.73 132.83 45.08 Favored 'General case' 0 N--CA 1.457 -0.114 0 O-C-N 122.212 -0.305 . . . . 0.0 111.706 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.1 mtm -83.73 152.56 24.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.59 0.356 . . . . 0.0 110.96 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.471 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.1 p90 . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 116.232 1.938 . . . . 0.0 116.232 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.77 164.46 33.56 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.806 3.004 . . . . 0.0 111.746 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -129.98 142.35 50.64 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 103.047 -2.945 . . . . 0.0 103.047 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -76.65 142.21 40.7 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.864 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.1 tt -83.88 150.32 25.79 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.196 0.998 . . . . 0.0 108.457 173.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -134.0 151.38 51.42 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 118.475 0.58 . . . . 0.0 111.147 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.4 pp -159.46 167.69 28.07 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.104 0.478 . . . . 0.0 111.43 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 12.5 p -162.6 174.05 13.13 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.293 1.037 . . . . 0.0 110.409 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -57.36 121.38 10.05 Favored 'General case' 0 C--N 1.34 0.156 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.9 t -77.83 149.15 34.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -170.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 0.6 OUTLIER -110.98 9.93 22.19 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 114.7 1.371 . . . . 0.0 114.7 169.545 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.22 166.57 16.06 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.161 0.984 . . . . 0.0 111.84 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -93.32 -3.03 54.21 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.84 177.97 3.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.575 0.75 . . . . 0.0 110.04 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -144.62 31.8 1.18 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.762 0.425 . . . . 0.0 111.607 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.89 -178.864 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo . . . . . 0 N--CA 1.452 -0.915 0 N-CA-C 110.719 -0.531 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -147.89 154.59 40.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 120.868 0.366 . . . . 0.0 110.815 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.43 161.14 30.1 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.151 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -75.44 -5.71 46.42 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.2 t -158.71 146.7 13.68 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 122.895 0.478 . . . . 0.0 110.553 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.21 -16.79 40.12 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.288 2.659 . . . . 0.0 110.519 174.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.57 148.77 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.7 tt -137.6 152.0 48.93 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.771 1.229 . . . . 0.0 107.966 -178.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.1 tpt -134.59 130.11 35.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.397 0.142 . . . . 0.0 110.779 -172.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.68 152.85 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -139.91 172.16 13.17 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 104.624 -2.361 . . . . 0.0 104.624 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.84 9.42 77.8 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 120.141 -0.255 . . . . 0.0 112.653 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.8 mt -79.02 27.89 0.23 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.553 0.676 . . . . 0.0 112.244 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.81 -41.46 95.77 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.0 pm0 -67.04 146.22 54.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.051 0.453 . . . . 0.0 111.016 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 56.6 m -68.68 -10.12 54.34 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -173.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -73.17 -19.62 61.08 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 117.939 0.336 . . . . 0.0 111.612 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 86.8 mmm -82.32 146.65 29.29 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.157 0.435 . . . . 0.0 110.587 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -160.92 155.74 23.89 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -59.13 -36.79 75.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -176.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -68.23 -39.33 82.37 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -75.93 -47.51 24.9 Favored 'General case' 0 C--N 1.34 0.153 0 O-C-N 122.192 -0.318 . . . . 0.0 111.651 -173.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.38 -37.74 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.8 -31.84 57.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -75.94 -29.9 58.51 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.703 1.138 . . . . 0.0 110.296 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -60.13 -55.8 21.74 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 2.5 p90 -76.57 -3.93 40.18 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 117.505 2.409 . . . . 0.0 117.505 174.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . 0.42 ' HG ' HG13 ' A' ' 406' ' ' VAL . 40.6 t -74.95 -35.0 62.14 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.059 -0.401 . . . . 0.0 110.803 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.09 -15.83 26.66 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.13 -7.39 59.64 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 117.295 2.331 . . . . 0.0 117.295 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.64 -143.21 6.99 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 -176.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -113.77 132.94 55.66 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.801 0.44 . . . . 0.0 110.773 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.42 HG13 ' HG ' ' A' ' 401' ' ' CYS . 1.2 m -114.01 165.5 8.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -117.63 -67.42 0.99 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -154.45 170.51 21.21 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.73 148.48 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.066 0 C-N-CA 123.845 0.858 . . . . 0.0 109.42 -177.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -152.31 108.52 3.4 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 122.576 0.351 . . . . 0.0 111.415 -174.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -73.24 163.88 27.48 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 24.0 ptp -142.18 142.03 32.66 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -5.57 54.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.742 1.617 . . . . 0.0 112.987 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.6 t -77.87 -8.18 57.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.109 0.563 . . . . 0.0 112.238 -172.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -141.03 157.52 66.89 Favored Pre-proline 0 CA--C 1.528 0.12 0 C-N-CA 123.644 0.777 . . . . 0.0 109.598 -177.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -67.54 -12.23 34.92 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.181 2.588 . . . . 0.0 111.496 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.05 95.4 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.56 160.41 38.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.208 0.603 . . . . 0.0 110.05 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.03 153.95 23.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.22 0.533 . . . . 0.0 111.732 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 83.3 mtp -96.97 153.29 17.99 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.948 0.899 . . . . 0.0 108.985 172.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.8 t -145.51 153.83 13.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -139.07 134.29 32.75 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 30.3 mtp -151.86 173.31 14.94 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 123.757 0.823 . . . . 0.0 109.388 -170.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.31 125.07 23.92 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 169.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.93 -33.1 65.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -167.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.17 -89.33 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -73.74 -23.69 59.79 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.97 -32.56 15.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 118.737 -1.185 . . . . 0.0 112.107 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.2 -25.06 6.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 120.179 1.354 . . . . 0.0 109.082 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -68.53 -50.15 54.2 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 118.056 0.389 . . . . 0.0 111.302 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.64 -37.0 85.32 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.35 80.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.732 0.697 . . . . 0.0 110.674 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.2 mt -77.72 -12.76 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 123.028 0.531 . . . . 0.0 110.81 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.8 m -96.8 -18.96 19.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -129.5 -25.76 2.6 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 116.161 1.912 . . . . 0.0 116.161 -169.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -129.52 -14.32 4.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.144 1.338 . . . . 0.0 113.473 -172.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.578 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.94 100.91 2.55 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -168.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.552 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 10.1 m-80 76.69 21.27 1.28 Allowed 'General case' 0 N--CA 1.481 1.088 0 O-C-N 117.916 -2.99 . . . . 0.0 112.264 -162.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -84.03 157.45 21.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -77.51 139.37 39.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.6 ttt -159.12 138.61 11.55 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.022 0.529 . . . . 0.0 109.597 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.399 49.8 m-85 56.92 25.79 10.95 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 -178.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 77.95 10.33 86.3 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 111.501 -0.639 . . . . 0.0 111.501 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -134.83 -167.3 1.96 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.861 1.264 . . . . 0.0 108.913 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -132.29 147.81 52.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.285 0.234 . . . . 0.0 111.031 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 18.7 ptt? -125.36 87.23 2.67 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 176.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.552 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.0 m120 -55.45 128.35 33.92 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 115.634 -2.127 . . . . 0.0 111.907 -174.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.578 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.423 2.4 t -126.82 154.15 36.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.28 -3.368 . . . . 0.0 116.059 169.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 37.9 t -162.09 167.42 24.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.568 1.547 . . . . 0.0 107.757 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.93 147.91 10.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 26.2 t -79.44 165.18 23.33 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 122.52 0.328 . . . . 0.0 110.5 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.4 31.56 6.27 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -137.12 160.91 64.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 172.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -75.0 -37.1 2.18 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.986 2.457 . . . . 0.0 116.198 -167.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -166.01 154.5 11.06 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.946 1.248 . . . . 0.0 112.889 -176.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 66.0 mt -77.05 150.83 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 173.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 54.9 mtm -129.27 136.79 29.7 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 117.584 0.175 . . . . 0.0 111.319 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.78 168.75 23.65 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.085 3.19 . . . . 0.0 110.564 177.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 143.37 -115.04 0.88 Allowed Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -72.43 153.55 41.35 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.1 0.56 . . . . 0.0 110.454 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 46.9 m -152.96 172.56 16.62 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.135 0.974 . . . . 0.0 110.03 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -144.58 164.07 32.01 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -83.38 132.08 10.83 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.22 163.37 26.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 174.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.69 -18.52 64.95 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -120.55 23.11 10.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.102 0.561 . . . . 0.0 109.931 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.97 -162.31 15.75 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.691 -0.631 . . . . 0.0 112.351 -176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 98.2 p -133.1 -10.74 2.95 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 122.727 0.411 . . . . 0.0 112.001 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.1 t -127.09 155.9 42.55 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.912 0.485 . . . . 0.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 80.2 p -115.72 8.96 15.07 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.446 0.698 . . . . 0.0 111.794 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -135.5 146.29 47.96 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -155.37 157.65 37.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.468 0.175 . . . . 0.0 110.64 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -128.77 139.35 52.24 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -173.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -133.78 5.07 3.63 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 31.9 t -65.39 -22.69 66.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.266 0.627 . . . . 0.0 111.825 -174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -113.89 1.48 14.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.156 0.582 . . . . 0.0 111.479 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -79.66 153.33 29.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.526 0.33 . . . . 0.0 111.365 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -85.42 -7.51 58.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.509 0.324 . . . . 0.0 111.283 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . 0.451 HD22 ' CD2' ' A' ' 561' ' ' HIS . 5.6 m-20 -60.13 -20.74 59.81 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -60.5 127.61 32.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -70.11 -33.76 72.25 Favored 'General case' 0 N--CA 1.458 -0.066 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -170.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.363 55.8 m-85 -98.14 17.53 18.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.5 t -60.0 -28.57 67.83 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -172.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.56 155.32 75.37 Favored Pre-proline 0 C--N 1.339 0.129 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -178.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.27 -25.37 76.64 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.306 2.671 . . . . 0.0 112.066 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -74.65 -29.75 61.37 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -80.43 -45.42 17.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.78 66.12 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.6 -25.0 56.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.936 0.335 . . . . 0.0 111.609 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -124.02 3.84 8.67 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -61.19 154.7 22.64 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.425 0.557 . . . . 0.0 111.679 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -154.63 141.87 19.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.0 mm -137.22 148.66 26.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.648 0.779 . . . . 0.0 109.337 -174.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -148.52 170.03 18.96 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.512 0.725 . . . . 0.0 110.59 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -64.43 157.09 74.13 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.71 148.32 90.16 Favored 'Trans proline' 0 N--CA 1.448 -1.197 0 C-N-CA 122.524 2.15 . . . . 0.0 109.808 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.9 t -153.95 173.66 15.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.815 0.446 . . . . 0.0 109.839 -173.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -83.74 -3.18 57.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.279 -0.263 . . . . 0.0 110.732 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -96.95 138.22 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 176.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 65.6 mt -125.5 156.52 38.85 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.19 0.596 . . . . 0.0 109.862 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -124.53 143.42 50.68 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -132.96 160.13 37.98 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.977 0.418 . . . . 0.0 111.452 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -144.16 150.96 38.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 51.83 57.42 6.54 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.304 1.042 . . . . 0.0 112.587 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -104.14 156.33 35.89 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.512 0.725 . . . . 0.0 110.302 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.83 153.04 32.65 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.317 2.678 . . . . 0.0 112.742 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.67 -16.34 63.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.442 0.697 . . . . 0.0 112.047 -176.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -122.92 20.99 9.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.523 0.729 . . . . 0.0 110.949 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.74 -16.12 19.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.578 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.47 -177.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -165.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.578 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -22.72 -41.04 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -170.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.2 mt-10 -58.49 -47.53 83.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 117.268 -1.349 . . . . 0.0 114.358 172.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -87.0 -28.32 22.71 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 122.416 2.371 . . . . 0.0 106.776 -172.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -65.35 -37.57 87.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 119.22 -0.992 . . . . 0.0 113.599 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -75.98 -37.66 58.28 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -81.71 -22.16 37.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.491 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.1 mt -75.94 -41.46 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 CA-C-N 118.624 0.647 . . . . 0.0 110.065 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.0 m -67.88 -34.77 77.31 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.089 0.404 . . . . 0.0 111.092 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.51 -34.74 72.65 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -69.19 -25.13 64.18 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.494 0.317 . . . . 0.0 110.922 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.81 -5.18 35.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.332 0.653 . . . . 0.0 111.552 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.2 -3.86 43.96 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.473 0.559 . . . . 0.0 113.02 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.8 m -78.79 164.56 3.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 CA-C-N 117.777 0.789 . . . . 0.0 112.522 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -67.37 149.1 50.75 Favored 'General case' 0 C--N 1.338 0.088 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -84.17 149.06 54.78 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.889 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.33 150.0 70.28 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.127 2.551 . . . . 0.0 110.589 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -85.24 -18.18 34.77 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 35.7 m -150.51 155.44 39.49 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.41 0.684 . . . . 0.0 110.982 176.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 91.7 t -144.01 147.92 19.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 123.644 0.777 . . . . 0.0 110.072 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -149.71 141.75 23.91 Favored 'General case' 0 N--CA 1.457 -0.081 0 C-N-CA 123.311 0.644 . . . . 0.0 109.369 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.71 142.74 31.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 123.227 0.611 . . . . 0.0 112.089 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -155.94 -173.8 4.68 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 99.0 p -138.53 -171.08 2.97 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.276 1.031 . . . . 0.0 110.115 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.52 7.77 57.79 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 119.779 -0.456 . . . . 0.0 112.326 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -125.56 -14.03 6.41 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 117.594 0.697 . . . . 0.0 112.154 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 34.8 t -162.23 148.31 13.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.861 0.464 . . . . 0.0 110.502 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -97.76 -8.07 29.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.916 0.486 . . . . 0.0 110.614 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -85.03 -38.64 18.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.245 0.618 . . . . 0.0 112.116 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 3.6 m -161.82 165.41 27.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.938 0.495 . . . . 0.0 111.816 -172.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 66.2 m -80.04 170.21 16.78 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.612 0.765 . . . . 0.0 111.697 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.2 m -142.97 165.06 28.38 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 124.392 1.077 . . . . 0.0 108.688 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.0 -170.08 43.23 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.046 -178.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.84 158.81 29.47 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.908 0.883 . . . . 0.0 110.349 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.3 mt -139.96 158.71 43.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 108.665 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.6 148.63 28.87 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.171 -0.331 . . . . 0.0 111.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -123.77 170.91 10.06 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 124.818 1.247 . . . . 0.0 112.644 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.81 -10.64 59.7 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.739 0.415 . . . . 0.0 111.037 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -156.48 160.39 39.51 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.678 -0.639 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -69.81 -30.67 68.25 Favored 'General case' 0 C--N 1.337 0.055 0 C-N-CA 122.412 0.285 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.4 p -75.36 -27.38 59.12 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -74.16 -32.49 63.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.597 0.359 . . . . 0.0 111.22 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.21 -36.95 58.35 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 175.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 37.3 tp -70.57 -37.4 73.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.321 -0.237 . . . . 0.0 111.446 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -70.69 -39.82 73.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.251 0.8 OUTLIER -68.99 -20.25 64.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 175.261 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.05 -42.55 89.37 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.18 -30.13 75.27 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.684 -0.509 . . . . 0.0 111.949 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.337 9.6 m-85 -96.74 -2.97 43.27 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 66.0 mt -127.25 -9.13 5.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -73.87 147.01 43.65 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.689 1.132 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.451 ' CD2' HD22 ' A' ' 479' ' ' ASN . 2.0 t-80 57.58 22.12 7.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.807 0.843 . . . . 0.0 112.204 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.34 134.78 56.95 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -77.16 119.29 20.64 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 122.285 -0.26 . . . . 0.0 110.729 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 74.6 mtm -83.57 152.69 24.73 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.148 0.499 . . . . 0.0 112.107 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt . . . . . 0 N--CA 1.455 -0.21 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.123 170.925 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 114.598 1.332 . . . . 0.0 114.598 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.15 162.97 40.3 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.953 2.435 . . . . 0.0 110.849 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -129.91 142.31 50.67 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 103.348 -2.834 . . . . 0.0 103.348 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.6 OUTLIER -85.08 139.06 32.02 Favored 'General case' 0 CA--C 1.528 0.135 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -176.52 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 4.6 tt -85.22 145.79 27.4 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.541 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -133.47 151.92 51.84 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.044 -0.663 . . . . 0.0 111.036 178.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.62 165.14 37.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.583 0.552 . . . . 0.0 111.678 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 23.0 p -163.78 175.81 10.13 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.192 0.997 . . . . 0.0 110.257 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -58.89 125.49 23.77 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.6 t -82.17 152.07 26.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -171.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.3 t -118.26 12.71 13.53 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 169.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.05 161.3 24.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.826 0.85 . . . . 0.0 111.907 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -92.08 -3.2 56.05 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.414 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -152.84 169.98 21.46 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 123.84 0.856 . . . . 0.0 110.477 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.49 25.86 0.96 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.644 0.778 . . . . 0.0 110.148 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.502 -175.947 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 121.047 0.353 . . . . 0.0 112.969 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -150.0 155.99 40.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.276 0.63 . . . . 0.0 110.019 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.53 160.34 27.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.709 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.13 -0.92 33.68 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 36.1 t -155.19 148.58 18.49 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.921 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -60.79 -4.07 3.26 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 124.539 3.493 . . . . 0.0 113.945 176.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 p -139.67 157.22 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.106 0 CA-C-O 121.514 0.673 . . . . 0.0 109.319 -174.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.95 160.71 26.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.76 1.624 . . . . 0.0 109.09 -174.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 17.3 tpt -136.65 133.65 36.45 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 122.566 0.347 . . . . 0.0 110.717 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -126.93 152.68 35.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -140.26 173.88 11.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.14 11.81 75.17 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.396 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 47.7 mt -78.74 23.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 117.396 0.598 . . . . 0.0 111.181 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.27 10.5 p30 -74.24 26.85 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -173.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.46 156.55 45.18 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.282 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 25.6 m -68.44 -7.29 30.54 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.422 0.689 . . . . 0.0 112.362 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.27 -14.71 61.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 94.2 mmm -100.99 149.6 23.76 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.516 0.598 . . . . 0.0 111.586 -178.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -157.19 151.03 24.47 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.88 0.872 . . . . 0.0 109.336 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.0 p -59.27 -39.45 82.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -174.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -72.02 -34.82 69.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.316 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -76.09 -48.26 21.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.452 0.301 . . . . 0.0 111.499 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.5 p -67.42 -37.4 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -76.9 -32.06 57.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -171.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -76.2 -32.44 58.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 119.589 1.086 . . . . 0.0 110.114 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.21 -54.62 30.06 Favored 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.8 OUTLIER -76.52 -4.18 41.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 172.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.338 0.073 0 O-C-N 121.912 -0.492 . . . . 0.0 110.428 177.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.11 -18.23 23.7 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.973 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -82.86 -10.48 58.82 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.94 -156.47 24.84 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 118.345 0.52 . . . . 0.0 112.287 -176.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -96.94 131.61 43.55 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.546 -0.385 . . . . 0.0 111.052 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.51 8.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -119.18 -70.68 0.78 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 14.8 pttp -154.48 168.36 26.97 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.2 p -137.32 149.8 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.187 0.995 . . . . 0.0 110.704 -177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -150.72 121.31 7.45 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.316 0.646 . . . . 0.0 111.51 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -85.21 158.92 20.22 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 13.4 mmt -116.37 133.49 55.95 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . 0.407 ' HE3' ' CD1' ' A' ' 462' ' ' TYR . 32.3 mttp -79.36 -23.79 43.11 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 124.254 1.022 . . . . 0.0 111.619 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.3 t -77.81 -19.63 54.64 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -170.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -113.12 156.96 42.14 Favored Pre-proline 0 CA--C 1.527 0.094 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.32 -15.17 47.23 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.617 2.211 . . . . 0.0 110.451 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.27 106.09 0.2 Allowed Glycine 0 C--N 1.338 0.642 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 175.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.83 157.36 29.06 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.41 0.684 . . . . 0.0 110.044 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.12 156.42 21.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.599 0.237 . . . . 0.0 111.636 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 64.5 mtm -102.49 154.11 19.42 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.338 0.655 . . . . 0.0 109.75 171.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 12.0 t -140.27 115.13 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 122.88 0.472 . . . . 0.0 111.23 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -93.77 133.42 37.16 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 44.3 mtp -154.75 172.43 17.95 Favored 'General case' 0 C--N 1.335 -0.045 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -171.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -64.69 118.13 8.47 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 168.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -72.4 -33.37 67.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -167.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.17 -88.27 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -71.65 -30.62 65.94 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.17 -32.71 18.48 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.564 -0.855 . . . . 0.0 112.729 -173.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 61.1 t -88.38 -24.08 6.22 Favored 'Isoleucine or valine' 0 C--N 1.343 0.296 0 CA-C-N 119.987 1.267 . . . . 0.0 109.685 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -66.07 -50.82 62.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.408 172.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -64.27 -34.51 78.29 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.23 82.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.5 0.591 . . . . 0.0 110.296 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.1 mt -79.17 -8.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.223 0.609 . . . . 0.0 111.089 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 37.6 m -100.61 -18.79 16.41 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 177.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -125.73 -29.82 3.1 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 -169.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 94.6 mt -134.36 -10.06 2.52 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 120.449 1.477 . . . . 0.0 114.151 -170.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.58 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.2 p-10 -71.38 100.74 2.24 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.503 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 9.8 m-80 76.72 21.44 1.24 Allowed 'General case' 0 N--CA 1.479 1.025 0 O-C-N 117.795 -3.066 . . . . 0.0 112.477 -162.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -79.61 158.44 27.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 170.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.29 46.7 m-85 -72.85 42.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -174.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' MET . . . . . 0.427 ' HG2' ' CD2' ' A' ' 442' ' ' PHE . 16.0 ttt -59.74 145.98 43.14 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.791 -0.568 . . . . 0.0 110.43 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.427 ' CD2' ' HG2' ' A' ' 441' ' ' MET 0.289 62.0 m-85 55.92 8.82 0.39 Allowed 'General case' 0 C--O 1.231 0.104 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 72.62 13.58 77.95 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -175.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -133.02 -4.41 3.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.672 0.736 . . . . 0.0 112.19 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 62.99 150.99 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.439 1.496 . . . . 0.0 114.069 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.55 110.4 7.19 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 171.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.503 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.5 m120 -65.61 130.33 42.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 115.885 -2.007 . . . . 0.0 112.061 -171.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.58 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.426 1.9 t -127.62 150.08 33.14 Favored 'Isoleucine or valine' 0 C--N 1.362 1.145 0 C-N-CA 113.031 -3.468 . . . . 0.0 116.249 169.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.7 t -161.04 172.38 16.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.778 1.231 . . . . 0.0 108.139 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.9 p -71.24 146.7 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 17.4 t -80.47 155.77 26.89 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 122.861 0.464 . . . . 0.0 111.192 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -103.43 -4.01 24.66 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 121.959 0.104 . . . . 0.0 111.068 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -82.93 156.18 67.43 Favored Pre-proline 0 N--CA 1.455 -0.181 0 C-N-CA 123.038 0.535 . . . . 0.0 110.276 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -74.84 -37.75 2.01 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.89 2.394 . . . . 0.0 112.144 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.89 163.16 11.57 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.511 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.7 mt -82.3 138.76 18.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 45.8 mmm -102.2 123.65 42.56 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 122.67 0.388 . . . . 0.0 110.506 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -73.7 153.47 48.69 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.19 2.593 . . . . 0.0 109.374 174.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.8 -123.81 1.39 Allowed Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.907 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -72.49 163.85 27.35 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.914 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 470' ' ' SER . 97.5 p -151.21 176.22 11.41 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.123 0.969 . . . . 0.0 109.351 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.407 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 34.8 p90 -136.93 7.08 2.93 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.335 -0.228 . . . . 0.0 111.127 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.55 -172.71 55.14 Favored Glycine 0 CA--C 1.526 0.734 0 O-C-N 122.202 -0.311 . . . . 0.0 112.47 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 75.2 mt -144.92 170.09 16.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.761 1.224 . . . . 0.0 109.586 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -70.09 -28.81 65.71 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.001 -0.437 . . . . 0.0 111.129 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -120.62 9.71 10.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -142.05 164.3 26.86 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 91.8 p -94.51 -22.56 18.16 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.592 0.357 . . . . 0.0 111.94 -176.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.5 t -127.01 146.88 50.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.878 0.471 . . . . 0.0 110.328 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 461' ' ' SER . 89.0 p -88.65 9.54 23.83 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.779 0.832 . . . . 0.0 110.838 176.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -141.34 150.7 42.81 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.002 1.321 . . . . 0.0 114.328 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -155.93 148.07 23.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.992 0.36 . . . . 0.0 111.099 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -100.74 146.35 27.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -140.38 1.45 1.77 Allowed 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 89.8 p -66.28 -19.35 65.79 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.337 0.655 . . . . 0.0 112.039 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -114.03 2.86 15.11 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.512 0.725 . . . . 0.0 111.152 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -76.15 150.03 37.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.976 0.417 . . . . 0.0 111.611 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -81.44 -11.88 59.1 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.538 0.735 . . . . 0.0 110.656 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -66.22 -18.12 65.16 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -63.33 131.1 47.19 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.718 0.407 . . . . 0.0 110.457 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.2 tpt85 -80.93 -33.77 33.83 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.318 62.9 m-85 -98.0 9.14 43.52 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 117.889 2.551 . . . . 0.0 117.889 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 28.2 m -75.53 -3.58 34.99 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.04 147.72 61.86 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -71.7 -24.77 21.29 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.269 2.646 . . . . 0.0 111.466 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -82.87 -25.78 32.21 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.003 0.365 . . . . 0.0 110.601 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -80.07 -43.94 20.93 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.143 -0.348 . . . . 0.0 110.185 173.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -58.76 -18.63 33.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.02 -19.24 44.31 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -124.05 8.13 8.62 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -65.13 154.11 38.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.135 0.425 . . . . 0.0 111.448 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -151.42 137.07 17.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 178.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.8 mm -141.55 140.57 31.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.058 0 C-N-CA 123.526 0.73 . . . . 0.0 109.39 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -149.42 169.28 21.23 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.07 0.948 . . . . 0.0 109.948 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -60.15 152.92 59.87 Favored Pre-proline 0 N--CA 1.455 -0.185 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.37 156.12 61.92 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.996 2.464 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 44.3 t -154.83 175.77 13.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.7 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -83.66 -4.86 58.95 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.283 -0.26 . . . . 0.0 110.423 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -94.01 138.2 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 176.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 82.9 mt -126.31 153.7 44.48 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.268 0.627 . . . . 0.0 109.855 175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -124.0 131.1 53.52 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -123.93 158.41 32.05 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 -176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -143.75 150.59 38.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -174.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 50.93 57.09 7.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.748 1.219 . . . . 0.0 112.728 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.12 160.58 25.51 Favored Pre-proline 0 N--CA 1.454 -0.251 0 C-N-CA 123.594 0.758 . . . . 0.0 110.265 175.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.46 152.1 27.81 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.265 2.643 . . . . 0.0 112.535 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.57 -16.51 63.89 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.872 0.469 . . . . 0.0 111.934 -177.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -122.94 25.88 8.38 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.876 0.87 . . . . 0.0 110.751 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -64.61 -13.91 15.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.5 OUTLIER -54.81 -177.41 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -165.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.59 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.46 -39.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -169.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.0 mt-10 -59.74 -43.65 94.16 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 172.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.96 -28.78 21.25 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 122.181 2.264 . . . . 0.0 106.873 -174.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -66.98 -33.34 75.36 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -76.53 -42.19 44.03 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -73.2 -26.34 61.12 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 75.6 mt -76.9 -41.33 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.162 0.437 . . . . 0.0 110.902 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 89.8 m -68.34 -35.09 77.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.178 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -69.45 -38.49 77.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -71.1 -27.74 63.81 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.509 0.323 . . . . 0.0 111.533 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.8 mt -93.53 -4.1 51.64 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.8 0.44 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.07 32.56 58.4 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.943 -0.473 . . . . 0.0 112.626 175.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.6 m -127.03 164.68 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 117.554 0.677 . . . . 0.0 111.585 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.52 142.9 57.36 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -83.58 153.8 65.08 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.25 146.66 76.56 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 123.017 2.478 . . . . 0.0 110.729 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.1 t -85.01 -15.82 42.88 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.0 t -150.32 153.08 35.47 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.808 0.443 . . . . 0.0 109.878 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 72.8 t -141.67 145.3 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 123.39 0.676 . . . . 0.0 109.91 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -145.81 138.12 25.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.352 0.661 . . . . 0.0 109.365 176.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 18.4 t -141.77 140.16 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 C-N-CA 123.667 0.787 . . . . 0.0 110.393 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -155.36 169.08 25.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 -176.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.3 p -79.53 170.47 16.52 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.806 0.842 . . . . 0.0 111.485 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . 0.459 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 82.68 -174.38 53.04 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.941 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 62.7 -19.44 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.151 1.78 . . . . 0.0 113.86 -177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' SER . . . . . 0.459 ' H ' ' C ' ' A' ' 534' ' ' GLY . 43.8 t -161.67 157.93 25.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 110.228 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -116.96 -7.77 11.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.505 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -88.14 -34.8 17.74 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 123.363 0.665 . . . . 0.0 112.237 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 4.0 m -160.59 170.68 20.38 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.016 0.526 . . . . 0.0 111.283 -173.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.4 t -79.89 165.5 22.61 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.44 0.696 . . . . 0.0 111.567 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.6 m -147.89 161.8 40.57 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.413 1.085 . . . . 0.0 109.588 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.56 -170.6 43.74 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.963 -178.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -119.16 159.96 23.01 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.943 0.897 . . . . 0.0 110.356 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.2 mt -141.46 159.79 41.49 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 108.94 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -150.26 149.22 29.86 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 117.782 0.264 . . . . 0.0 111.355 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.0 m-90 -124.42 171.91 9.57 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 124.986 1.314 . . . . 0.0 112.48 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -74.48 -12.38 60.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.389 0.276 . . . . 0.0 110.478 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.5 t -157.51 156.06 31.37 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 121.707 -0.62 . . . . 0.0 111.135 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -23.24 63.45 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 122.256 -0.278 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 51.3 m -78.22 -25.29 46.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -78.09 -32.23 50.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.54 0.336 . . . . 0.0 110.708 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.07 -25.56 58.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.334 -0.228 . . . . 0.0 110.431 175.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 60.1 tp -74.66 -41.58 60.04 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.274 -0.266 . . . . 0.0 110.962 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.77 -35.74 75.16 Favored 'General case' 0 N--CA 1.456 -0.145 0 O-C-N 121.965 -0.459 . . . . 0.0 109.903 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.95 -23.57 55.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 177.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.84 -39.44 90.79 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.89 -37.35 88.08 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.339 27.7 m-85 -84.47 -4.59 59.02 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 118.85 2.907 . . . . 0.0 118.85 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 85.5 mt -122.15 -22.0 5.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.049 0.84 . . . . 0.0 113.09 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -70.85 139.17 50.77 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 119.369 0.986 . . . . 0.0 110.388 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 58.91 12.78 2.47 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.645 1.178 . . . . 0.0 112.968 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.268 36.6 t80 -71.25 140.8 50.52 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -72.2 137.8 47.14 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.156 -0.34 . . . . 0.0 111.704 -175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.9 mtm -83.41 145.28 29.08 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 122.356 0.263 . . . . 0.0 110.802 177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 60.4 pttt . . . . . 0 C--O 1.233 0.186 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.726 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.87 164.98 27.11 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.902 3.068 . . . . 0.0 111.96 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -130.0 142.3 50.65 Favored 'General case' 0 C--O 1.23 0.069 0 N-CA-C 102.618 -3.104 . . . . 0.0 102.618 173.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.262 0.7 OUTLIER -74.64 138.31 42.82 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.7 tt -89.59 147.1 24.12 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.507 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.2 OUTLIER -140.34 158.53 43.88 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.574 -178.776 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.93 169.36 23.67 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.232 0.539 . . . . 0.0 111.041 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 51.5 t -155.91 164.07 38.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.445 1.098 . . . . 0.0 109.377 -175.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -57.36 121.07 9.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 174.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 41.5 t -75.79 144.6 41.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -169.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 t -112.25 13.52 20.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.88 -1.054 . . . . 0.0 113.684 169.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.28 162.92 13.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.242 1.017 . . . . 0.0 111.909 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -87.35 -3.07 59.02 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.967 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -177.52 176.57 1.26 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.32 1.048 . . . . 0.0 110.081 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -137.19 23.3 3.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.657 0.783 . . . . 0.0 110.917 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.129 -1.415 . . . . 0.0 111.09 -177.195 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 N--CA 1.453 -0.903 0 N-CA-C 111.166 -0.359 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -151.93 156.4 40.0 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.233 0.613 . . . . 0.0 110.376 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.21 157.45 37.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.676 0.39 . . . . 0.0 110.836 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -83.35 6.69 19.02 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -154.28 145.05 16.11 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.119 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.36 -7.39 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.911 3.074 . . . . 0.0 112.686 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.41 154.43 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -173.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.2 tt -132.36 154.55 49.64 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.76 1.624 . . . . 0.0 108.103 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 13.9 tpt -134.95 136.49 42.3 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.308 0.243 . . . . 0.0 110.949 -174.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -130.62 151.59 36.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -175.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -137.2 172.74 12.54 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.54 11.11 80.66 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.843 -0.421 . . . . 0.0 112.881 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.5 mt -77.97 28.04 0.18 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.802 0.801 . . . . 0.0 112.25 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.42 -39.17 91.8 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -66.61 148.69 51.56 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.094 0.473 . . . . 0.0 111.147 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.6 p -70.61 -6.72 38.84 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.887 0.875 . . . . 0.0 113.008 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -78.54 -13.45 59.82 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.61 0.364 . . . . 0.0 111.611 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 70.0 mmm -84.69 148.98 26.11 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -163.03 162.21 25.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 16.6 p -59.68 -32.31 70.37 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 122.112 -0.368 . . . . 0.0 111.267 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -73.29 -30.71 63.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.27 -51.67 14.62 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 12.5 m -65.03 -39.0 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.875 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.528 ' CE1' HG11 ' A' ' 406' ' ' VAL 0.358 1.9 m-85 -67.85 -51.89 43.04 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 175.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -58.08 -36.34 72.71 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.255 -173.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 28.5 t -60.4 -64.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.334 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.504 5.3 p90 -76.51 -5.82 49.17 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 118.226 2.676 . . . . 0.0 118.226 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.62 -32.42 53.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.998 0.519 . . . . 0.0 110.036 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -59.2 -17.73 30.25 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.008 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -89.87 -17.5 27.94 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.73 179.36 44.32 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 118.494 0.588 . . . . 0.0 112.941 -176.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -75.33 146.74 40.7 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -175.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.528 HG11 ' CE1' ' A' ' 397' ' ' PHE . 24.1 t -114.15 163.35 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.979 1.311 . . . . 0.0 113.206 -172.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -132.87 -66.89 0.65 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.192 -0.432 . . . . 0.0 111.726 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -153.31 156.51 38.51 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.745 0.702 . . . . 0.0 112.833 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . 0.525 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.8 p -141.43 148.03 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 174.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -153.5 123.88 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.617 0.246 . . . . 0.0 111.312 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -74.76 162.37 28.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 66.4 mtm -135.11 126.67 28.8 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 121.347 0.594 . . . . 0.0 112.118 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -5.58 54.65 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 124.509 1.124 . . . . 0.0 111.801 176.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 91.6 p -77.96 -4.02 44.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.759 0.424 . . . . 0.0 111.208 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -138.49 158.51 70.35 Favored Pre-proline 0 CA--C 1.529 0.159 0 C-N-CA 124.492 1.117 . . . . 0.0 109.484 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.32 -13.68 40.93 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.149 2.566 . . . . 0.0 111.614 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.32 99.27 0.12 Allowed Glycine 0 C--N 1.336 0.534 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 175.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.94 156.76 35.1 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.814 0.446 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -155.95 146.28 21.68 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 111.219 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 81.4 mtp -88.61 147.84 24.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.1 t -142.13 118.5 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -102.34 134.17 46.06 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 70.0 mtp -153.71 173.91 15.21 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.58 116.96 7.38 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 169.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -72.25 -33.24 67.36 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -167.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.83 -87.35 0.02 OUTLIER Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -74.31 -24.42 59.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.93 -34.92 16.74 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.974 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 69.9 t -84.84 -25.04 7.02 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 118.573 -1.251 . . . . 0.0 109.041 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -66.66 -54.29 24.72 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.913 0.324 . . . . 0.0 111.647 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -64.3 -37.21 86.7 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.52 -35.13 77.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.239 0.472 . . . . 0.0 110.786 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.67 -10.68 12.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.523 0.329 . . . . 0.0 110.919 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 58.6 m -96.76 -20.31 18.31 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -125.61 -31.48 2.97 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.43 HD23 HD21 ' A' ' 439' ' ' ASN . 90.8 mt -134.26 -7.26 2.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.333 1.424 . . . . 0.0 114.299 -169.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.565 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.1 p-10 -71.17 100.94 2.16 Favored 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 -170.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.524 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 9.2 m-80 76.92 21.23 1.18 Allowed 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 123.97 3.077 . . . . 0.0 112.156 -162.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . 0.43 HD21 HD23 ' A' ' 436' ' ' LEU . 55.7 t30 -84.76 159.44 20.47 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 169.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -75.85 138.8 41.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' MET . . . . . 0.4 ' HE2' ' CE2' ' A' ' 442' ' ' PHE . 19.4 ttt -160.25 145.58 14.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.566 0.746 . . . . 0.0 109.081 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.4 ' CE2' ' HE2' ' A' ' 441' ' ' MET . 62.1 m-85 60.06 15.57 5.22 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.07 11.41 84.46 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -133.94 -161.44 1.14 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.608 1.563 . . . . 0.0 108.47 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.16 151.14 50.39 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 121.963 -0.461 . . . . 0.0 110.683 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -130.34 91.12 3.04 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.524 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.6 m120 -58.93 128.21 36.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 115.863 -2.018 . . . . 0.0 111.721 -173.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.565 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.42 1.9 t -128.21 150.47 33.98 Favored 'Isoleucine or valine' 0 C--N 1.367 1.348 0 C-N-CA 113.113 -3.435 . . . . 0.0 116.076 170.157 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 48.6 t -159.94 167.84 27.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.298 1.439 . . . . 0.0 108.618 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -70.74 148.93 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 21.4 t -85.01 158.13 20.56 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.783 0.433 . . . . 0.0 111.497 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -107.44 -1.33 21.57 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.386 0.275 . . . . 0.0 111.45 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -85.13 149.01 51.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.792 0.437 . . . . 0.0 110.621 175.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.47 -33.57 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.211 2.607 . . . . 0.0 112.542 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.07 157.79 11.71 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.064 0.393 . . . . 0.0 111.715 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 81.2 mt -83.39 145.23 8.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.4 mtp -114.75 126.98 27.26 Favored Pre-proline 0 CA--C 1.532 0.256 0 O-C-N 122.342 -0.224 . . . . 0.0 110.844 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.13 173.6 14.15 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 124.134 3.223 . . . . 0.0 110.286 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 136.63 -107.78 0.62 Allowed Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.034 -0.827 . . . . 0.0 111.034 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.37 158.34 35.96 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.326 0.65 . . . . 0.0 111.054 -177.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 40.6 t -161.1 163.81 31.15 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.8 0.84 . . . . 0.0 109.466 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -130.56 0.41 4.45 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.03 -177.3 54.37 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 122.934 0.302 . . . . 0.0 112.491 -178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.5 mt -143.7 157.75 44.17 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 124.343 1.057 . . . . 0.0 109.338 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.5 pm0 -71.82 -10.22 59.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.779 0.431 . . . . 0.0 112.073 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -120.48 20.25 11.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.323 0.649 . . . . 0.0 110.237 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -168.35 -151.74 7.27 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.0 t -133.05 -16.1 2.52 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.8 p -127.06 146.82 50.23 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.374 0.669 . . . . 0.0 111.4 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 93.1 p -92.44 -0.11 57.39 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.862 0.465 . . . . 0.0 110.434 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -126.81 144.96 50.81 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -155.37 156.68 35.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.257 0.2 OUTLIER -136.69 142.74 43.15 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -129.24 12.33 6.03 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 32.2 t -64.04 -25.14 67.98 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.465 0.706 . . . . 0.0 112.013 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -114.0 3.84 15.49 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.351 0.661 . . . . 0.0 111.62 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 45.4 t -75.82 153.6 36.77 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 111.687 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 54.4 ttt180 -83.42 -14.48 52.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.259 0.624 . . . . 0.0 110.717 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -63.24 -22.29 66.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.121 0.568 . . . . 0.0 112.255 -174.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -58.03 130.83 48.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -68.88 -33.84 74.45 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -170.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.413 56.9 m-85 -98.0 17.35 18.53 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.1 t -61.58 -25.73 67.51 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -172.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.57 151.84 76.72 Favored Pre-proline 0 C--O 1.232 0.14 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -177.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.09 -15.66 39.77 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.006 2.471 . . . . 0.0 109.872 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.8 -32.73 60.0 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -80.6 -47.09 14.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 174.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.78 -21.43 65.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.94 -22.55 55.86 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.22 -0.3 . . . . 0.0 111.647 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -124.05 -1.81 8.24 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -60.25 153.93 21.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.425 0.557 . . . . 0.0 111.655 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -152.86 147.34 25.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.5 mm -135.82 147.55 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 C-N-CA 123.252 0.621 . . . . 0.0 109.578 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -156.56 160.54 39.56 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.019 0.528 . . . . 0.0 110.044 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -61.01 155.09 56.78 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.749 0.42 . . . . 0.0 109.999 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.68 146.67 89.13 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.099 2.533 . . . . 0.0 111.065 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 92.5 p -151.48 176.66 11.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.552 0.741 . . . . 0.0 109.627 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -83.71 -2.14 55.59 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.03 142.93 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 123.199 0.6 . . . . 0.0 112.124 175.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.2 tp -137.69 151.75 48.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -124.22 149.99 45.77 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.783 0.833 . . . . 0.0 109.149 -177.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -142.11 159.9 41.29 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.612 0.72 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -149.69 160.04 43.85 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 102.719 -3.067 . . . . 0.0 102.719 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 58.45 57.39 3.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.327 -0.233 . . . . 0.0 111.472 -174.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -123.17 148.51 54.9 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 122.589 0.356 . . . . 0.0 111.202 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.24 155.47 29.45 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.67 2.913 . . . . 0.0 112.794 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.16 -16.38 63.97 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.324 0.649 . . . . 0.0 111.724 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -120.33 20.95 11.85 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.69 0.796 . . . . 0.0 111.183 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.58 -13.91 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.588 HG21 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.82 -177.3 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -166.158 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.588 ' H ' HG21 ' A' ' 510' ' ' THR . 23.1 pt-20 -24.05 -40.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.6 mt-10 -58.53 -46.22 87.27 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.289 -1.338 . . . . 0.0 114.449 173.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -87.93 -27.96 21.8 Favored 'General case' 0 C--N 1.351 0.635 0 CA-C-N 122.653 2.479 . . . . 0.0 106.669 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -63.7 -38.07 89.72 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -75.6 -42.7 51.19 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -75.07 -20.91 59.29 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.132 -177.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -77.29 -39.92 28.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 118.268 0.486 . . . . 0.0 110.032 175.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.7 m -69.02 -31.39 70.17 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 122.137 -0.352 . . . . 0.0 110.838 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -72.7 -32.93 66.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.42 0.288 . . . . 0.0 110.692 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -71.74 -27.72 63.18 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.76 -5.96 37.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.818 0.281 . . . . 0.0 111.68 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.93 -7.83 8.91 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 123.678 0.656 . . . . 0.0 113.362 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.2 m -77.34 174.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 118.41 1.105 . . . . 0.0 112.784 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.73 164.52 6.07 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 123.295 0.638 . . . . 0.0 111.922 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -127.16 150.14 71.45 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.587 0.755 . . . . 0.0 109.281 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.11 154.68 69.92 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.095 2.53 . . . . 0.0 111.631 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.9 t -89.33 -17.11 29.56 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 17.3 t -155.48 155.27 33.17 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.523 0.329 . . . . 0.0 110.208 177.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.5 m -141.79 155.22 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -147.56 141.2 25.57 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.597 0.759 . . . . 0.0 109.473 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.33 141.91 29.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.302 0.641 . . . . 0.0 111.796 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -155.23 167.57 29.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -91.02 175.14 7.06 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.917 0.887 . . . . 0.0 110.785 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 95.26 177.07 37.55 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 123.591 0.615 . . . . 0.0 111.71 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . 0.463 ' HB3' ' HZ2' ' A' ' 535' ' ' LYS . 0.2 OUTLIER 49.7 13.34 0.09 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.701 2.0 . . . . 0.0 114.432 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -160.85 157.65 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 123.797 0.839 . . . . 0.0 109.766 177.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -117.09 6.17 12.86 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -141.22 -10.62 0.96 Allowed 'General case' 0 C--N 1.341 0.198 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 45.2 t -154.31 163.85 39.5 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.463 0.574 . . . . 0.0 111.707 -170.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 60.1 p -90.11 173.63 8.07 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 111.349 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.5 m -145.72 165.8 27.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.595 1.158 . . . . 0.0 108.786 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.56 -174.27 46.06 Favored Glycine 0 CA--C 1.525 0.661 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.959 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.82 161.3 22.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.792 0.837 . . . . 0.0 110.299 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.1 mt -140.64 161.57 37.45 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.885 1.274 . . . . 0.0 108.784 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -148.05 149.76 32.68 Favored 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.936 0.346 . . . . 0.0 111.936 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -127.48 172.14 10.96 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.638 1.575 . . . . 0.0 112.333 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.21 -9.99 59.16 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.4 t -161.38 158.45 26.89 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.092 0.557 . . . . 0.0 110.339 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -73.52 -19.87 60.81 Favored 'General case' 0 CA--C 1.527 0.074 0 O-C-N 122.294 -0.254 . . . . 0.0 111.175 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 86.7 p -79.83 -25.48 40.78 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.92 0.327 . . . . 0.0 110.158 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -76.81 -35.85 57.33 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.323 0.249 . . . . 0.0 111.173 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.32 62.14 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 36.0 tp -73.89 -41.48 62.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.895 0.478 . . . . 0.0 110.12 178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -63.07 -47.07 84.49 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.061 0.457 . . . . 0.0 110.551 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -26.1 63.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 177.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.4 -38.9 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -63.78 -40.46 98.49 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.355 30.1 m-85 -91.13 -3.66 56.88 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 119.362 3.097 . . . . 0.0 119.362 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 74.5 mt -120.3 -4.86 9.92 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.498 1.045 . . . . 0.0 113.482 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -74.66 143.61 44.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.344 0.974 . . . . 0.0 108.54 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 58.07 19.28 5.87 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.591 0.757 . . . . 0.0 112.331 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -71.31 155.47 40.63 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -177.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -70.54 157.9 37.07 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.2 mtm -126.66 152.71 46.37 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.187 0.595 . . . . 0.0 111.917 173.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 169.061 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -83.57 169.25 12.35 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.616 2.877 . . . . 0.0 111.143 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -130.03 142.32 50.63 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 102.834 -3.024 . . . . 0.0 102.834 172.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -76.65 137.14 39.25 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 116.316 1.969 . . . . 0.0 116.316 -175.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.7 tt -87.42 150.03 24.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.437 1.095 . . . . 0.0 108.625 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -141.43 153.95 45.3 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.48 161.44 40.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.938 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.5 p -163.27 171.28 16.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.281 0.633 . . . . 0.0 111.626 -175.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -54.34 121.67 8.76 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.4 t -80.52 149.04 30.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -169.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 1.0 OUTLIER -111.68 9.22 20.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 169.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.41 168.75 15.4 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.261 1.025 . . . . 0.0 111.801 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -95.47 -3.12 47.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -175.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.74 178.03 4.24 Favored 'General case' 0 C--N 1.338 0.086 0 C-N-CA 123.346 0.659 . . . . 0.0 110.216 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.2 31.49 1.37 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.776 0.43 . . . . 0.0 111.768 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.252 1.192 0 CA-C-O 117.779 -1.105 . . . . 0.0 110.942 -178.879 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo . . . . . 0 N--CA 1.454 -0.821 0 CA-C-O 120.63 0.179 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -78.2 155.41 30.38 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.952 0.501 . . . . 0.0 110.017 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -71.93 155.47 40.32 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.808 0.337 . . . . 0.0 110.714 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -84.59 7.82 18.86 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 38.3 t -151.6 143.49 16.09 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 122.051 -0.406 . . . . 0.0 110.947 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.12 -1.39 2.86 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.292 3.328 . . . . 0.0 113.976 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.4 p -143.01 156.24 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-O 121.809 0.814 . . . . 0.0 109.202 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.54 164.17 24.37 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.078 1.751 . . . . 0.0 107.825 -177.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.1 ttt -144.13 138.64 28.32 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.816 0.735 . . . . 0.0 111.855 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.7 154.54 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 C-N-CA 124.136 0.974 . . . . 0.0 108.588 -175.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -141.89 171.8 13.56 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.94 10.63 75.11 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 112.057 -0.417 . . . . 0.0 112.057 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 53.8 mt -79.03 26.51 0.25 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.761 0.78 . . . . 0.0 111.879 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -62.9 -35.57 80.49 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -67.19 150.64 48.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.2 p -69.81 -7.17 37.63 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 123.687 0.795 . . . . 0.0 112.705 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -79.12 -7.39 58.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.367 0.667 . . . . 0.0 112.311 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 69.1 mmm -91.27 151.9 20.71 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.632 0.651 . . . . 0.0 111.259 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -159.54 155.51 26.49 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.574 0.75 . . . . 0.0 109.754 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 10.8 p -60.24 -38.36 83.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.29 -30.76 63.62 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -75.87 -43.28 46.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.656 0.382 . . . . 0.0 111.082 -177.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.497 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 1.1 m-85 -62.39 -53.39 55.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.099 2.259 . . . . 0.0 117.099 177.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -60.47 -32.49 71.45 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.351 -1.34 . . . . 0.0 109.787 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 11.0 t -60.92 -62.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.4 OUTLIER -76.54 -8.11 56.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 175.822 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.9 t -73.11 -29.66 63.08 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.917 -0.49 . . . . 0.0 109.951 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . 0.552 ' HB2' ' HG ' ' A' ' 578' ' ' CYS . 2.0 pp -60.18 -16.26 31.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.074 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -94.87 -6.86 41.77 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.104 2.261 . . . . 0.0 117.104 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.2 175.49 32.28 Favored Glycine 0 CA--C 1.527 0.844 0 CA-C-N 118.35 0.523 . . . . 0.0 112.85 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -70.35 137.31 50.47 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 111.719 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.497 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 15.1 m -114.03 165.31 9.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 124.959 1.304 . . . . 0.0 109.397 -176.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -139.39 -54.65 0.57 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -151.39 152.46 33.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.792 1.178 . . . . 0.0 112.972 -176.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 13.9 p -141.5 145.12 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 123.424 0.69 . . . . 0.0 109.914 176.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -153.6 128.23 9.37 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.872 0.469 . . . . 0.0 110.673 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -80.5 147.83 30.7 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 117.08 2.252 . . . . 0.0 117.08 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.1 mmt -83.3 128.55 34.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.431 0.692 . . . . 0.0 111.409 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . 0.539 ' HE3' ' CD1' ' A' ' 462' ' ' TYR . 36.6 mttp -79.3 -30.14 42.77 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 122.98 0.512 . . . . 0.0 111.108 173.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 28.4 t -79.77 -19.46 48.6 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.925 0.89 . . . . 0.0 112.956 -174.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -108.84 154.15 41.98 Favored Pre-proline 0 N--CA 1.455 -0.191 0 C-N-CA 123.068 0.547 . . . . 0.0 110.179 -175.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -67.96 -17.54 46.34 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.109 2.54 . . . . 0.0 111.293 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.45 103.68 0.17 Allowed Glycine 0 C--N 1.336 0.576 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -163.74 160.74 22.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.49 0.716 . . . . 0.0 109.385 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.47 143.11 16.06 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 79.4 mtp -81.18 149.55 29.05 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.3 t -142.68 102.05 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -84.51 134.38 34.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 75.0 mtp -153.6 171.46 18.73 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 123.723 0.809 . . . . 0.0 109.716 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -67.49 114.73 6.39 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 169.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -72.43 -33.87 67.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -166.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -52.49 -89.16 0.01 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.251 55.5 m-85 -77.93 -20.66 52.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 117.389 2.366 . . . . 0.0 117.389 -176.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -89.0 -35.76 16.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 119.021 -1.071 . . . . 0.0 111.673 -176.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.6 t -84.82 -26.67 6.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.221 0 C-N-CA 118.722 -1.191 . . . . 0.0 108.24 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -62.14 -62.88 1.46 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 173.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -65.83 -29.14 69.56 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.34 -36.13 78.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.736 0.698 . . . . 0.0 110.401 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 -11.49 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.907 0.483 . . . . 0.0 110.793 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.8 m -94.53 -21.85 18.6 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -130.13 -19.26 3.21 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -169.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.72 -12.33 2.3 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.669 1.577 . . . . 0.0 114.573 -175.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.559 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.51 100.98 2.35 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -169.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.557 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 11.1 m-80 76.91 22.05 1.1 Allowed 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 124.05 3.114 . . . . 0.0 113.21 -162.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.84 159.09 25.17 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.593 -0.692 . . . . 0.0 110.117 167.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.26 137.98 41.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 15.8 ttt -157.77 141.18 15.41 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.256 0.623 . . . . 0.0 109.665 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 58.55 16.65 4.39 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 81.63 11.3 83.18 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -132.66 -161.83 1.17 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.782 1.633 . . . . 0.0 108.373 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.78 149.23 49.06 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.886 -0.509 . . . . 0.0 110.8 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -126.39 82.36 2.07 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.446 0.698 . . . . 0.0 109.417 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.557 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.1 m120 -54.41 127.95 29.65 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 115.497 -2.192 . . . . 0.0 112.678 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.559 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.0 t -127.77 149.17 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 113.464 -3.294 . . . . 0.0 116.519 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.43 168.55 24.92 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.281 1.432 . . . . 0.0 107.653 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.89 150.07 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.1 t -88.62 157.98 18.4 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.133 0.573 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -105.51 -3.47 22.41 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.446 0.298 . . . . 0.0 111.182 178.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -75.49 156.58 85.12 Favored Pre-proline 0 CA--C 1.53 0.207 0 C-N-CA 123.259 0.624 . . . . 0.0 110.467 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.85 -35.47 0.99 Allowed 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.897 2.398 . . . . 0.0 112.193 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.57 167.94 9.47 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.393 0.677 . . . . 0.0 110.399 -175.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 65.5 mt -93.89 136.43 25.49 Favored 'Isoleucine or valine' 0 C--O 1.23 0.063 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 69.7 mmm -85.27 130.66 50.91 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-O 119.719 -0.182 . . . . 0.0 110.685 175.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -77.77 27.82 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.807 3.671 . . . . 0.0 111.341 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -74.54 -143.41 0.86 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.955 0.788 . . . . 0.0 113.535 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -72.53 166.95 21.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.727 0.811 . . . . 0.0 111.366 -174.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -146.11 175.46 10.46 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.928 0.891 . . . . 0.0 110.8 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.539 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 32.3 p90 -141.28 -178.4 5.58 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.734 0.813 . . . . 0.0 108.847 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.82 177.18 45.01 Favored Glycine 0 CA--C 1.528 0.867 0 O-C-N 122.031 -0.418 . . . . 0.0 113.02 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 28.0 mt -140.94 168.61 19.37 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 124.24 1.016 . . . . 0.0 109.745 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -71.78 -31.22 66.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.325 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -120.57 18.47 12.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.768 0.427 . . . . 0.0 110.442 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.28 172.99 42.43 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.495 -0.753 . . . . 0.0 112.444 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 95.0 p -99.77 -16.61 18.04 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.99 136.97 52.98 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.25 0.477 . . . . 0.0 111.013 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 94.8 p -83.63 -0.5 50.84 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.113 0.965 . . . . 0.0 111.634 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.265 4.0 t80 -131.24 149.16 52.69 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -155.27 150.47 26.96 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -177.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.285 0.3 OUTLIER -129.89 140.94 50.88 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 178.149 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.48 7.52 10.1 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 39.3 t -65.34 -19.62 66.04 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.983 0.513 . . . . 0.0 111.764 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -113.91 2.26 15.01 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.126 0.57 . . . . 0.0 111.539 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.1 t -80.74 151.96 28.58 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.67 0.388 . . . . 0.0 111.349 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -81.64 -13.41 57.97 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.705 0.402 . . . . 0.0 111.191 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -59.52 -23.53 62.89 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -57.35 113.1 1.61 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.25 0.62 . . . . 0.0 109.775 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -75.32 -29.73 60.11 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.31 64.7 m-85 -98.0 15.03 25.31 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 43.8 t -71.34 -18.36 62.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' THR . . . . . 0.41 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.65 151.36 78.01 Favored Pre-proline 0 C--O 1.233 0.216 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.3 Cg_exo -64.26 -32.51 62.03 Favored 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.345 2.697 . . . . 0.0 112.667 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -78.68 -27.33 45.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.115 0.416 . . . . 0.0 110.496 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -74.44 -41.13 61.37 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 174.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -63.43 -17.06 62.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.35 -0.218 . . . . 0.0 111.386 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -87.16 -10.54 52.43 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -124.02 -10.17 7.66 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -63.83 155.67 29.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -152.61 146.26 25.05 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 44.7 mm -123.21 149.32 26.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 C-N-CA 123.505 0.722 . . . . 0.0 109.516 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -156.02 155.95 33.58 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.823 0.449 . . . . 0.0 109.852 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -59.8 156.94 31.67 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.917 0.487 . . . . 0.0 109.906 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -62.91 142.67 89.25 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.182 1.922 . . . . 0.0 108.905 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.6 t -154.5 167.07 31.28 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.915 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -83.68 -2.54 56.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.802 0.441 . . . . 0.0 110.718 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.33 140.13 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.503 0.721 . . . . 0.0 112.403 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.9 mt -128.85 156.47 43.59 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.065 0.546 . . . . 0.0 110.118 176.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -115.65 150.23 37.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -137.46 154.98 49.82 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -151.57 166.83 29.97 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 102.959 -2.978 . . . . 0.0 102.959 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 56.55 57.53 4.78 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.003 -0.436 . . . . 0.0 111.663 -174.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -133.0 148.92 71.33 Favored Pre-proline 0 N--CA 1.454 -0.248 0 C-N-CA 122.427 0.291 . . . . 0.0 110.61 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.42 161.06 47.38 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.003 2.468 . . . . 0.0 110.917 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.61 -16.38 63.83 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.485 0.314 . . . . 0.0 111.008 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -100.44 12.18 37.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.404 0.682 . . . . 0.0 111.532 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.33 -18.22 23.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.586 HG23 ' H ' ' A' ' 511' ' ' GLU . 1.1 m -55.07 -177.27 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.811 -1.09 . . . . 0.0 113.686 -166.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.586 ' H ' HG23 ' A' ' 510' ' ' THR . 23.4 pt-20 -23.09 -41.18 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -169.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.7 mt-10 -57.86 -47.22 83.35 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 173.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -88.04 -27.91 21.7 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 122.356 2.343 . . . . 0.0 106.296 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.33 -37.27 86.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -75.27 -42.23 55.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.65 -24.22 49.49 Favored 'General case' 0 CA--C 1.526 0.024 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.222 -177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.04 -41.7 52.45 Favored 'Isoleucine or valine' 0 C--N 1.337 0.052 0 CA-C-N 118.864 0.756 . . . . 0.0 109.984 176.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 99.7 m -65.98 -26.99 67.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.056 -0.403 . . . . 0.0 110.853 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -70.17 -41.31 73.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -71.35 -24.46 62.1 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -89.24 -5.96 57.21 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.313 0.245 . . . . 0.0 111.212 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 69.19 -7.45 3.35 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 123.702 0.668 . . . . 0.0 113.867 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.4 m -83.9 172.83 1.0 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-N 118.459 1.129 . . . . 0.0 113.33 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.8 152.05 32.53 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.292 1.037 . . . . 0.0 113.077 -174.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 47.3 mtm105 -95.59 149.92 36.75 Favored Pre-proline 0 CA--C 1.529 0.141 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.828 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -69.74 150.29 68.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.137 2.558 . . . . 0.0 110.658 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -92.19 -14.11 29.55 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.6 t -152.58 155.52 37.53 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.358 0.263 . . . . 0.0 110.716 176.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 61.0 t -145.3 145.68 20.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 123.688 0.795 . . . . 0.0 111.31 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -147.36 142.34 26.98 Favored 'General case' 0 CA--C 1.526 0.056 0 C-N-CA 123.894 0.877 . . . . 0.0 109.334 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.69 143.03 31.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 122.981 0.513 . . . . 0.0 111.218 -176.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.1 p90 -155.67 -178.31 7.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 69.9 m -131.42 177.69 7.3 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 110.858 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.95 -5.78 59.76 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.792 0.711 . . . . 0.0 112.689 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -93.22 -20.34 20.54 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-N 117.886 0.843 . . . . 0.0 111.167 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 36.9 t -164.45 155.27 15.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.23 0.612 . . . . 0.0 110.432 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.98 -7.93 31.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.463 0.305 . . . . 0.0 110.517 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -89.23 -31.52 17.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.5 p -160.83 168.53 24.52 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.458 0.646 . . . . 0.0 112.287 -172.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 29.8 t -81.36 167.22 19.71 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.611 1.164 . . . . 0.0 111.379 178.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -146.72 159.74 43.1 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 124.373 1.069 . . . . 0.0 109.518 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.99 -173.82 45.7 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.84 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -119.27 159.76 23.48 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.413 0.685 . . . . 0.0 110.693 -177.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.7 mt -140.61 159.26 42.58 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.081 1.352 . . . . 0.0 108.414 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.99 149.1 29.18 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.979 -0.451 . . . . 0.0 111.183 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -124.04 171.0 10.1 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 125.027 1.331 . . . . 0.0 112.479 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -73.63 -12.66 60.81 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.803 0.441 . . . . 0.0 111.487 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.7 t -157.19 160.15 38.43 Favored 'General case' 0 C--N 1.339 0.115 0 O-C-N 121.687 -0.633 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.84 -29.89 68.31 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.201 0.2 . . . . 0.0 110.822 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 89.7 p -76.4 -26.01 55.14 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -74.85 -35.42 62.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.336 0.255 . . . . 0.0 110.932 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.04 -37.18 66.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.17 -37.66 78.3 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.236 -0.29 . . . . 0.0 110.247 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -62.0 -45.71 92.42 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.093 0.473 . . . . 0.0 110.264 176.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.6 m -69.9 -28.18 65.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.09 -35.7 81.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.14 -44.82 90.36 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.464 -0.631 . . . . 0.0 111.888 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -89.65 -24.6 21.6 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.33 -18.62 20.63 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -173.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.38 152.36 39.56 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.621 -0.674 . . . . 0.0 110.428 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.49 17.28 4.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.023 1.329 . . . . 0.0 113.182 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -69.75 139.3 53.31 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -75.85 138.9 41.41 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.863 -0.523 . . . . 0.0 111.945 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.3 mtm -83.49 152.66 24.82 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.125 0.488 . . . . 0.0 111.624 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.226 0 C-N-CA 124.175 0.99 . . . . 0.0 113.062 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.5 p90 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 159.77 52.18 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.601 2.201 . . . . 0.0 111.348 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.39 142.29 50.84 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 102.542 -3.133 . . . . 0.0 102.542 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.276 0.7 OUTLIER -78.15 138.53 38.76 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -176.029 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.47 150.79 25.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.977 1.311 . . . . 0.0 108.203 172.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.536 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -140.06 152.78 46.47 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.986 -177.71 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 10.8 mt -132.27 164.91 25.37 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.822 0.849 . . . . 0.0 111.144 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . 0.552 ' HG ' ' HB2' ' A' ' 402' ' ' LEU . 47.6 t -159.17 154.42 25.42 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.742 0.817 . . . . 0.0 109.21 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -59.93 117.06 4.61 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 174.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.3 t -73.0 146.95 45.6 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -169.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -112.32 10.82 19.99 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 169.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.3 162.54 17.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.619 0.768 . . . . 0.0 111.321 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -86.17 -3.8 59.04 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.727 -175.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -176.24 178.07 1.44 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.674 1.19 . . . . 0.0 109.576 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -133.23 16.62 4.1 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.866 0.467 . . . . 0.0 111.682 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.261 179.718 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo . . . . . 0 N--CA 1.455 -0.754 0 N-CA-C 111.598 -0.193 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -155.9 153.68 30.04 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.027 0.442 . . . . 0.0 111.09 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.22 163.4 25.81 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.142 0.577 . . . . 0.0 111.185 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -74.09 -7.11 51.37 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.6 t -159.05 148.26 14.55 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.495 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . 0.417 ' HA ' ' HB3' ' A' ' 425' ' ' ASP . 74.2 Cg_endo -67.61 -14.56 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.349 2.7 . . . . 0.0 110.737 173.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.61 149.84 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -137.24 152.95 50.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.792 1.237 . . . . 0.0 108.225 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -133.96 133.44 41.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.398 -0.189 . . . . 0.0 110.512 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -129.91 152.04 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.086 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -140.74 173.13 11.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.72 10.71 78.69 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.437 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.6 mt -80.69 25.13 0.44 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.464 0.705 . . . . 0.0 112.201 -178.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -65.38 -39.87 92.78 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -175.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -67.28 149.66 50.08 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.133 0.492 . . . . 0.0 111.143 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 88.0 p -68.26 -8.63 41.07 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -77.71 -20.37 53.67 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 118.116 0.416 . . . . 0.0 111.182 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 64.9 mmm -82.06 147.87 28.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 122.178 -0.326 . . . . 0.0 110.252 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.07 155.78 25.8 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -60.71 -30.5 70.0 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -71.81 -40.03 69.44 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 61.0 mtt85 -76.05 -41.12 51.72 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 -175.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.58 -43.66 77.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -176.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -76.83 -29.54 55.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.429 -0.796 . . . . 0.0 109.198 -169.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -78.84 -30.21 45.08 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 119.991 1.269 . . . . 0.0 110.0 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -54.77 29.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.557 2.4 p90 -76.72 -7.34 55.17 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 172.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.7 t -69.28 -26.39 64.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 78.8 mt -54.4 -24.36 19.48 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -92.94 -11.07 34.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -173.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 170.68 176.87 40.32 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 118.205 0.457 . . . . 0.0 112.199 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -68.61 136.28 52.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.853 0.359 . . . . 0.0 111.683 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.06 165.52 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -119.97 -70.96 0.76 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.449 0.3 . . . . 0.0 111.238 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -154.44 170.68 20.81 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 9.2 p -146.03 149.37 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.369 1.068 . . . . 0.0 110.513 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -155.8 137.86 14.58 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.353 0.661 . . . . 0.0 111.075 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.4 m-85 -88.23 156.53 19.17 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 21.9 mmt -98.38 118.86 36.0 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 122.879 0.472 . . . . 0.0 111.882 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -14.42 59.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.148 0.179 . . . . 0.0 110.686 169.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 98.9 p -84.23 1.3 45.25 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.752 0.821 . . . . 0.0 112.377 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -139.38 155.66 72.03 Favored Pre-proline 0 CA--C 1.528 0.115 0 C-N-CA 123.665 0.786 . . . . 0.0 110.134 -177.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -68.34 -16.08 43.15 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.174 2.583 . . . . 0.0 111.647 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.77 93.77 0.09 OUTLIER Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.41 161.55 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.467 0.707 . . . . 0.0 109.329 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.49 151.25 25.91 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.129 0.49 . . . . 0.0 111.958 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 36.8 ttm -96.11 147.29 23.88 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.6 t -141.17 152.46 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -138.56 133.69 32.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 42.6 mtp -152.36 174.17 14.16 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.346 1.058 . . . . 0.0 109.053 -171.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.85 124.25 21.97 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . 0.417 ' HB3' ' HA ' ' A' ' 379' ' ' PRO . 8.5 p30 -72.53 -32.26 65.96 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.744 -1.222 . . . . 0.0 114.164 -166.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.07 -90.84 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 O-C-N 124.559 1.162 . . . . 0.0 110.775 -176.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.296 64.7 m-85 -75.85 -20.24 58.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.2 -33.99 15.98 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 118.569 -1.253 . . . . 0.0 111.371 -175.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.6 t -86.97 -26.96 5.89 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 C-N-CA 118.238 -1.385 . . . . 0.0 109.057 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -67.5 -51.37 52.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.651 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -65.49 -35.83 82.06 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.965 -0.46 . . . . 0.0 112.111 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.29 83.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.604 0.638 . . . . 0.0 110.417 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.5 mt -77.13 -14.15 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 122.848 0.459 . . . . 0.0 110.899 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 15.5 m -94.7 -19.78 20.11 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 114.452 1.279 . . . . 0.0 114.452 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -126.07 -27.99 3.21 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.9 mt -134.38 -8.94 2.55 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -172.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.56 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -70.27 105.32 2.94 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -168.365 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.552 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 15.3 m-80 75.15 22.08 1.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 116.788 -3.695 . . . . 0.0 115.055 -164.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -77.36 161.45 28.03 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.307 -0.871 . . . . 0.0 109.707 167.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -79.62 138.37 37.4 Favored 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 177.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.2 ttt -159.51 136.95 9.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.289 0.636 . . . . 0.0 110.174 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.389 52.0 m-85 57.32 26.65 12.66 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.02 9.79 86.69 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.261 -0.735 . . . . 0.0 111.261 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -135.84 -164.67 1.58 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.019 1.328 . . . . 0.0 108.779 -178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.46 147.22 52.13 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.698 0.285 . . . . 0.0 111.33 -176.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.5 ptm -118.57 75.6 1.03 Allowed 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 124.477 1.111 . . . . 0.0 109.171 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.552 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.3 m120 -53.7 127.19 24.71 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 115.979 -1.963 . . . . 0.0 112.265 -173.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.56 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.2 t -126.71 152.06 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 113.537 -3.265 . . . . 0.0 115.877 169.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 43.2 t -160.74 165.74 29.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.523 1.529 . . . . 0.0 108.324 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.14 147.93 11.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 O-C-N 121.56 -0.713 . . . . 0.0 112.56 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.4 t -88.14 157.72 18.75 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 122.827 0.451 . . . . 0.0 111.35 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -97.55 -5.66 35.26 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.087 0.155 . . . . 0.0 110.652 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -77.84 152.57 80.2 Favored Pre-proline 0 N--CA 1.456 -0.153 0 C-N-CA 123.546 0.739 . . . . 0.0 111.029 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.56 -36.06 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.363 2.709 . . . . 0.0 112.139 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.99 159.69 9.5 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.358 0.663 . . . . 0.0 110.707 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.23 132.41 32.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 37.0 mmm -100.33 126.24 36.76 Favored Pre-proline 0 N--CA 1.454 -0.24 0 C-N-CA 122.454 0.301 . . . . 0.0 110.707 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.62 153.79 44.03 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.186 2.591 . . . . 0.0 109.102 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 167.81 -127.8 1.62 Allowed Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.86 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -72.45 172.95 9.51 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.1 p -156.36 172.3 18.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.044 0.538 . . . . 0.0 110.215 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -137.16 4.44 2.7 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.0 -176.2 53.93 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 56.0 mt -145.65 168.76 19.9 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.053 0.941 . . . . 0.0 109.916 -178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . 0.401 ' H ' ' CD ' ' A' ' 465' ' ' GLU . 2.4 pm0 -65.3 -31.38 72.49 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.065 0.546 . . . . 0.0 110.364 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -120.5 10.02 11.04 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.47 172.82 30.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.739 -0.545 . . . . 0.0 111.739 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 92.0 p -101.72 -15.03 17.11 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 122.89 0.476 . . . . 0.0 111.997 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.11 145.69 50.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.864 0.465 . . . . 0.0 110.171 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 78.6 p -85.49 10.4 13.1 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.396 0.678 . . . . 0.0 111.301 177.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -138.18 149.9 46.26 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.29 150.98 30.35 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 120.801 0.334 . . . . 0.0 110.485 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -124.09 138.37 54.44 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.156 0.983 . . . . 0.0 113.577 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.23 2.53 5.18 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 95.9 p -66.11 -15.91 63.5 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.123 0.569 . . . . 0.0 112.158 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -113.98 -0.38 14.1 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.05 0.54 . . . . 0.0 111.369 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 68.6 m -79.84 150.83 30.54 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.599 0.36 . . . . 0.0 111.522 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -79.47 -12.56 59.88 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.987 0.515 . . . . 0.0 111.193 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.18 -18.99 62.62 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -176.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -61.75 115.04 3.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -73.06 -31.52 64.45 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.447 0.299 . . . . 0.0 111.59 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.29 61.1 m-85 -97.93 17.4 18.31 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 42.6 t -64.43 -20.9 66.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.86 151.39 70.28 Favored Pre-proline 0 C--O 1.231 0.129 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.59 27.01 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.111 2.541 . . . . 0.0 111.923 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -80.13 -20.15 45.61 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.255 0.48 . . . . 0.0 110.705 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -85.73 -39.7 16.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 172.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.96 64.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.761 0.424 . . . . 0.0 111.996 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.27 -21.36 53.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -124.08 7.74 8.59 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.03 156.63 38.32 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.453 0.57 . . . . 0.0 111.913 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -118.6 146.47 44.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.553 0.741 . . . . 0.0 110.728 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.3 mm -143.57 138.29 25.64 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.21 159.3 35.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -58.81 154.91 34.24 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -65.16 146.57 87.04 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.32 2.013 . . . . 0.0 109.073 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -155.95 170.95 20.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.309 0.244 . . . . 0.0 110.636 -173.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -83.7 -1.19 53.56 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.569 0.348 . . . . 0.0 111.034 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.77 137.57 29.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.5 mt -123.32 161.48 24.58 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.232 0.613 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -130.17 143.76 50.97 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.736 1.214 . . . . 0.0 108.316 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.86 163.24 30.69 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.445 0.64 . . . . 0.0 112.067 -177.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -149.31 162.53 39.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 57.1 57.36 4.61 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.736 0.414 . . . . 0.0 111.727 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -121.64 151.27 56.82 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 122.686 0.394 . . . . 0.0 111.989 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.84 152.61 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.585 2.857 . . . . 0.0 112.921 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.61 -16.43 63.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.173 0.589 . . . . 0.0 111.444 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -123.05 25.62 8.44 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.394 0.677 . . . . 0.0 110.696 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.79 -12.59 14.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.57 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.91 -177.31 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.865 -1.065 . . . . 0.0 113.854 -165.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.57 ' H ' HG21 ' A' ' 510' ' ' THR . 22.9 pt-20 -26.46 -37.27 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -169.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.3 mt-10 -58.22 -47.38 83.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 117.07 -1.443 . . . . 0.0 114.559 171.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -88.19 -26.7 22.26 Favored 'General case' 0 C--N 1.353 0.718 0 CA-C-N 122.732 2.514 . . . . 0.0 107.113 -173.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -67.63 -34.49 77.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.503 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -75.2 -42.86 54.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -76.19 -21.34 56.58 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.802 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.96 -40.6 26.86 Favored 'Isoleucine or valine' 0 C--N 1.339 0.113 0 CA-C-N 118.423 0.556 . . . . 0.0 109.954 175.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 87.7 m -68.4 -34.59 76.31 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.958 -0.464 . . . . 0.0 110.933 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.16 -38.1 84.88 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -70.54 -28.39 64.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 122.114 -0.366 . . . . 0.0 111.032 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -92.51 -4.12 54.07 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.263 0.625 . . . . 0.0 111.519 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.58 -2.0 59.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.15 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.0 t -77.1 153.55 5.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 118.072 0.936 . . . . 0.0 112.182 178.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -68.36 151.68 46.52 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.399 . . . . 0.0 110.294 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.9 ptt85 -78.07 156.14 79.56 Favored Pre-proline 0 CA--C 1.53 0.2 0 C-N-CA 122.685 0.394 . . . . 0.0 110.365 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.06 154.29 72.93 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.111 2.541 . . . . 0.0 110.386 173.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.3 t -85.39 -17.28 37.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.1 t -156.97 152.72 27.0 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.558 0.343 . . . . 0.0 110.173 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.1 m -143.44 154.73 16.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 123.719 0.808 . . . . 0.0 112.35 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -150.75 144.33 25.05 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.181 0.592 . . . . 0.0 109.973 176.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -138.08 150.73 24.85 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 C-N-CA 123.398 0.679 . . . . 0.0 112.218 177.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -152.83 174.84 13.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.7 t -142.96 168.91 18.59 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.556 0.742 . . . . 0.0 109.624 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 115.15 -16.47 17.74 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 123.857 0.741 . . . . 0.0 111.985 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -80.91 -26.48 36.74 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 117.795 0.797 . . . . 0.0 111.131 175.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.2 t -163.9 157.35 18.58 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.747 0.819 . . . . 0.0 109.686 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -96.99 -6.89 34.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.539 0.336 . . . . 0.0 110.532 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -78.18 -41.54 34.33 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 32.5 t -161.13 163.56 31.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -170.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -90.36 167.32 12.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.096 0.958 . . . . 0.0 111.702 -177.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.3 m -145.44 165.66 27.91 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 124.996 1.318 . . . . 0.0 108.748 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.69 -170.77 43.92 Favored Glycine 0 CA--C 1.525 0.701 0 C-N-CA 120.554 -0.832 . . . . 0.0 113.322 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.03 159.84 26.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.036 0.934 . . . . 0.0 110.228 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.51 156.91 45.7 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 124.588 1.155 . . . . 0.0 109.085 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -148.18 149.38 31.87 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 117.925 0.33 . . . . 0.0 111.664 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.0 m-90 -126.81 172.53 10.3 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 124.828 1.251 . . . . 0.0 112.152 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -76.13 -9.59 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.666 0.386 . . . . 0.0 110.556 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.9 t -158.4 158.93 35.15 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.623 -0.673 . . . . 0.0 111.669 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -69.45 -24.9 63.87 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 122.368 0.267 . . . . 0.0 110.502 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 49.2 m -77.91 -27.49 49.53 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -74.31 -32.15 62.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -77.83 -25.91 49.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.7 tp -77.38 -37.16 52.66 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.199 0.199 . . . . 0.0 111.317 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -75.61 -38.54 58.92 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.591 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.264 0.2 OUTLIER -71.6 -22.28 61.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 12.1 tp -67.91 -37.44 81.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 170.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.11 -30.46 76.93 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.315 11.5 m-85 -101.32 -2.57 30.72 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 84.6 mt -125.05 -3.63 7.56 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.287 0.948 . . . . 0.0 113.29 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -79.88 139.58 37.08 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.739 1.154 . . . . 0.0 109.586 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 56.74 19.37 4.32 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 175.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -77.86 149.96 34.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 104.103 -2.555 . . . . 0.0 104.103 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -78.34 143.38 36.96 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.719 0.408 . . . . 0.0 111.992 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.1 mtm -83.57 152.65 24.75 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 111.259 175.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.138 0.975 . . . . 0.0 111.295 177.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.254 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -77.58 164.22 28.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 123.751 2.967 . . . . 0.0 111.675 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -129.93 142.29 50.67 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 172.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.02 141.96 32.76 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -82.3 146.1 29.61 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 172.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.513 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.2 OUTLIER -135.14 148.48 49.76 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 117.829 0.286 . . . . 0.0 110.237 -179.469 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.3 pp -154.99 165.46 36.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.181 0.515 . . . . 0.0 111.811 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 31.3 p -159.8 174.42 14.51 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.971 0.908 . . . . 0.0 109.887 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -61.04 126.43 27.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.4 t -84.29 156.09 22.11 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -172.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -122.08 11.78 10.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.317 1.047 . . . . 0.0 113.604 170.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.58 162.92 14.59 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.087 0.955 . . . . 0.0 111.659 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -85.73 -3.23 58.84 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.65 178.21 3.18 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.027 0.931 . . . . 0.0 109.359 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -132.41 16.43 4.47 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.987 0.515 . . . . 0.0 111.465 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.614 -1.184 . . . . 0.0 110.492 -179.861 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 N--CA 1.456 -0.727 0 N-CA-C 110.816 -0.494 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -146.33 158.32 43.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.819 0.448 . . . . 0.0 110.539 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.41 160.65 31.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.623 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -78.95 -3.43 44.89 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.379 0.672 . . . . 0.0 110.576 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -155.12 148.64 18.61 Favored Pre-proline 0 C--O 1.233 0.21 0 O-C-N 121.726 -0.609 . . . . 0.0 112.058 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -61.33 -5.84 5.89 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 124.246 3.297 . . . . 0.0 113.029 172.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 153.33 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.091 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.7 tt -128.07 154.49 45.64 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.655 1.582 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.9 tpt -137.4 133.55 34.9 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 117.847 0.294 . . . . 0.0 110.971 -175.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.54 153.44 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -146.12 170.48 16.61 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 87.72 6.94 75.83 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.669 -0.517 . . . . 0.0 113.07 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.05 45.28 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.106 0.962 . . . . 0.0 111.372 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -82.04 -13.47 57.29 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -174.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -83.76 147.14 27.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.672 0.389 . . . . 0.0 110.176 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 91.1 p -72.67 -7.32 49.81 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -81.47 -17.4 48.85 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.651 0.38 . . . . 0.0 111.353 -177.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 92.5 mmm -83.66 162.63 20.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.351 0.596 . . . . 0.0 111.487 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -167.74 168.76 12.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.612 1.565 . . . . 0.0 106.79 176.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -61.67 -34.25 75.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.379 0.536 . . . . 0.0 110.95 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -74.74 -29.51 61.19 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -74.23 -51.54 15.09 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 122.127 -0.358 . . . . 0.0 111.052 -175.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.7 p -72.6 -37.61 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -73.37 -32.06 64.29 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.13 -48.37 80.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 118.897 0.771 . . . . 0.0 111.403 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 31.0 t -56.69 -55.63 18.63 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 1.4 p90 -76.52 -5.8 49.11 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 29.0 t -77.4 -34.05 54.9 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.699 -0.626 . . . . 0.0 111.657 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.66 -12.23 22.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 119.916 -0.714 . . . . 0.0 111.597 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.81 2.77 40.8 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 169.94 -144.38 8.48 Favored Glycine 0 CA--C 1.525 0.688 0 O-C-N 121.805 -0.559 . . . . 0.0 112.008 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -116.17 131.65 56.88 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.9 m -113.94 165.59 8.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -175.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -118.42 -65.95 1.12 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.563 0.345 . . . . 0.0 111.662 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . 0.439 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 36.2 mtmm -150.57 169.3 21.87 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.325 0.511 . . . . 0.0 111.914 -173.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.9 p -146.78 147.83 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 123.95 0.9 . . . . 0.0 109.264 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -154.63 140.74 18.44 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.582 0.353 . . . . 0.0 111.118 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.281 5.2 m-85 -94.44 156.52 16.44 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 117.052 2.242 . . . . 0.0 117.052 -178.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.4 mmt -93.75 125.17 38.22 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.008 0.523 . . . . 0.0 112.234 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.12 -14.32 59.2 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 124.311 1.044 . . . . 0.0 111.802 176.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 90.4 p -97.18 1.25 49.59 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.364 0.666 . . . . 0.0 112.483 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -131.44 152.81 81.15 Favored Pre-proline 0 CA--C 1.53 0.196 0 C-N-CA 123.165 0.586 . . . . 0.0 110.293 -175.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -71.07 -14.68 32.08 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.303 2.669 . . . . 0.0 111.737 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.21 90.81 0.08 OUTLIER Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.63 156.23 37.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.91 154.01 29.06 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.945 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.2 ptm -107.64 150.01 27.4 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 9.4 t -141.18 130.33 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -173.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -107.18 131.93 53.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 47.6 mtp -153.29 171.29 18.79 Favored 'General case' 0 C--O 1.231 0.092 0 C-N-CA 123.211 0.605 . . . . 0.0 109.377 -172.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.79 115.89 6.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -72.35 -33.44 67.27 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.78 -87.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -75.07 -25.56 58.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -175.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.35 -36.09 16.8 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.053 -174.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.57 -26.45 6.5 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.042 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -64.43 -53.4 49.01 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 117.981 0.355 . . . . 0.0 111.947 173.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -69.91 -29.18 66.29 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.01 80.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.599 0.636 . . . . 0.0 110.144 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.0 mt -78.6 -15.44 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.147 0.579 . . . . 0.0 110.73 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 45.3 m -91.37 -20.82 21.42 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.55 -24.35 2.01 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -128.91 -12.14 4.75 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.731 1.605 . . . . 0.0 113.78 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.524 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.79 101.07 2.51 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -168.468 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.552 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 17.3 m-80 78.85 21.82 0.69 Allowed 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 123.643 2.928 . . . . 0.0 113.639 -160.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -81.09 157.85 25.24 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.469 -0.769 . . . . 0.0 109.073 167.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -78.58 139.05 38.64 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.9 ttt -154.17 133.96 12.98 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.404 ' CZ ' ' CD1' ' A' ' 558' ' ' PHE 0.356 53.5 m-85 56.69 22.6 6.98 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 -176.509 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.81 11.03 66.19 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.741 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -146.38 146.4 30.62 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 117.775 0.788 . . . . 0.0 111.002 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -77.61 149.95 34.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.996 0.518 . . . . 0.0 111.361 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.1 ptt? -131.48 83.67 2.12 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.494 0.717 . . . . 0.0 109.281 176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.552 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 28.9 t-20 -54.66 129.26 35.96 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.163 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.524 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.461 2.1 t -123.79 150.61 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 113.118 -3.433 . . . . 0.0 115.953 168.417 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 33.8 t -160.82 172.01 17.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.538 1.135 . . . . 0.0 108.211 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -73.23 147.19 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.6 t -86.78 155.68 20.22 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.226 0.61 . . . . 0.0 111.491 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -92.88 -7.53 45.96 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -77.58 145.7 71.91 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.049 0.94 . . . . 0.0 110.34 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.7 -33.87 2.11 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.019 2.48 . . . . 0.0 111.388 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.91 161.66 10.89 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.439 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 64.5 mt -83.61 129.03 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 mmm -91.93 122.41 65.29 Favored Pre-proline 0 N--CA 1.454 -0.257 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 174.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.81 144.02 47.35 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.665 2.243 . . . . 0.0 108.827 174.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 169.69 -134.56 3.22 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.582 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -72.55 160.9 31.52 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.371 0.669 . . . . 0.0 111.369 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.3 p -145.03 171.94 13.77 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.461 1.104 . . . . 0.0 109.546 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -133.65 -0.49 3.18 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.35 179.78 51.14 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 112.172 -0.371 . . . . 0.0 112.172 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 81.9 mt -143.37 154.19 43.48 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.864 0.866 . . . . 0.0 109.25 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -75.26 -4.08 36.97 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.447 0.299 . . . . 0.0 110.98 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -120.43 11.11 11.34 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.223 1.009 . . . . 0.0 113.698 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -163.74 -144.84 4.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.056 -1.218 . . . . 0.0 110.056 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 97.6 p -133.0 -24.52 1.89 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.269 0.534 . . . . 0.0 112.138 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.2 t -127.06 149.73 49.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.754 0.421 . . . . 0.0 110.286 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.2 p -91.7 9.89 30.57 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.28 0.632 . . . . 0.0 110.856 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -143.92 150.9 39.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -155.22 157.68 37.7 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.606 0.241 . . . . 0.0 110.363 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -133.31 133.69 42.88 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -176.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.64 1.43 9.46 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.7 p -72.86 -6.91 48.15 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.545 0.738 . . . . 0.0 111.314 -179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -113.95 16.79 18.23 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.885 0.874 . . . . 0.0 111.528 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -139.03 150.92 46.35 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.87 6.48 41.69 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.909 0.884 . . . . 0.0 112.185 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -63.5 -25.72 68.39 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -67.32 150.37 49.1 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -69.9 -33.78 72.65 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.337 -0.545 . . . . 0.0 112.071 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.418 56.6 m-85 -98.08 10.19 41.04 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 177.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.4 t -69.24 -21.66 63.91 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -171.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -133.3 150.86 76.4 Favored Pre-proline 0 CA--C 1.529 0.145 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.53 -23.5 27.22 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.168 2.579 . . . . 0.0 112.0 -177.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -73.76 -24.11 59.82 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.452 0.569 . . . . 0.0 110.217 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -83.21 -52.72 6.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 174.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.25 -20.39 64.19 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.762 0.825 . . . . 0.0 112.622 -171.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.51 60.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 117.943 0.338 . . . . 0.0 111.634 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -124.03 6.65 8.59 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.61 155.44 15.52 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.492 0.587 . . . . 0.0 112.233 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -152.98 147.23 25.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.0 mm -136.61 151.45 28.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 C-N-CA 123.379 0.671 . . . . 0.0 109.734 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -155.99 158.02 37.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -61.84 154.94 64.92 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -62.39 144.06 94.44 Favored 'Trans proline' 0 N--CA 1.449 -1.096 0 C-N-CA 122.811 2.341 . . . . 0.0 109.909 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.9 t -153.45 -179.99 8.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -83.73 0.01 48.98 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.989 -0.444 . . . . 0.0 110.802 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.0 t -100.18 137.24 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.3 mt -125.59 159.81 31.19 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 109.134 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -128.81 147.03 50.76 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -133.52 159.89 39.07 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -150.62 163.57 38.19 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 56.93 43.49 24.63 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.154 -0.341 . . . . 0.0 111.537 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.52 150.8 39.44 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.13 153.46 32.71 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.448 2.765 . . . . 0.0 112.673 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.55 -16.52 63.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.079 0.552 . . . . 0.0 111.581 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -122.95 24.07 9.11 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.514 0.726 . . . . 0.0 110.98 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.8 p -64.29 -13.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.76 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -165.836 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.581 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -25.55 -37.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -169.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.1 mt-10 -58.37 -48.69 79.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 117.244 -1.36 . . . . 0.0 114.22 171.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -86.21 -27.16 24.67 Favored 'General case' 0 C--N 1.352 0.68 0 CA-C-N 122.407 2.367 . . . . 0.0 106.747 -173.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -64.57 -39.81 94.41 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -71.97 -42.45 66.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.35 -26.85 56.15 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.042 -1.063 . . . . 0.0 111.155 -177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.9 mt -70.55 -39.61 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 CA-C-N 118.825 0.739 . . . . 0.0 110.456 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.04 -34.16 77.45 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.012 -0.43 . . . . 0.0 110.786 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -70.77 -27.19 63.74 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -80.53 -8.55 59.62 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.354 0.261 . . . . 0.0 111.618 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.4 mt -114.91 -2.88 12.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.738 0.415 . . . . 0.0 111.578 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.28 0.35 56.96 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 119.78 -0.455 . . . . 0.0 112.271 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.0 148.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 CA-C-N 117.778 0.789 . . . . 0.0 110.851 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -69.55 145.5 52.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 120.89 0.376 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 -71.26 150.68 94.4 Favored Pre-proline 0 N--CA 1.455 -0.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.412 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.2 158.73 56.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.841 3.028 . . . . 0.0 111.095 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -90.9 -23.13 20.59 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.6 m -154.13 152.16 30.1 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.979 0.511 . . . . 0.0 111.119 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.04 156.56 19.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.76 0.824 . . . . 0.0 112.993 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -153.67 143.25 21.73 Favored 'General case' 0 C--O 1.228 -0.046 0 C-N-CA 122.918 0.487 . . . . 0.0 109.824 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.29 149.33 25.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.498 0.719 . . . . 0.0 112.207 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -156.45 -171.52 3.73 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.3 t -140.68 -176.65 4.73 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.872 0.869 . . . . 0.0 109.948 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.8 74.44 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.847 0.737 . . . . 0.0 111.967 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -96.36 -17.03 20.94 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 117.429 0.614 . . . . 0.0 111.279 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 48.3 t -164.05 151.55 12.27 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.3 0.64 . . . . 0.0 110.082 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.06 -7.77 31.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.667 0.387 . . . . 0.0 110.546 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -86.68 -33.72 19.97 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.603 0.761 . . . . 0.0 112.465 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 96.4 p -162.89 173.37 13.79 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.076 0.465 . . . . 0.0 111.48 -169.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.4 t -88.31 166.69 14.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.485 0.714 . . . . 0.0 110.934 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.1 p -149.69 162.86 39.39 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.382 1.073 . . . . 0.0 108.427 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.44 -172.79 45.67 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.572 -177.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -113.3 159.45 19.36 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.595 0.758 . . . . 0.0 110.321 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 15.0 tp -145.64 152.19 39.25 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.963 0.905 . . . . 0.0 108.726 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -150.44 148.65 29.01 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-N 119.197 0.908 . . . . 0.0 112.921 -174.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -123.47 175.73 6.6 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 125.245 1.418 . . . . 0.0 112.802 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.61 -5.38 57.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 40.7 t -158.31 155.73 29.35 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.195 0.598 . . . . 0.0 110.61 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -72.67 -24.21 60.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.521 0.328 . . . . 0.0 111.12 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.8 p -79.16 -24.12 43.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.931 0.332 . . . . 0.0 110.442 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -76.99 -31.6 56.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.424 0.29 . . . . 0.0 111.385 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.77 -28.04 58.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.34 -39.78 62.59 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.162 -0.336 . . . . 0.0 111.073 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -70.15 -36.77 74.97 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.483 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.3 m -69.79 -27.8 65.2 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.87 -38.26 90.17 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.82 -38.32 94.25 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 442' ' ' PHE 0.298 8.0 m-85 -92.44 -3.0 55.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 119.214 3.042 . . . . 0.0 119.214 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 37.4 mt -133.92 -6.71 2.75 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -69.76 143.22 53.07 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 120.46 1.482 . . . . 0.0 108.991 176.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 60.49 18.94 8.72 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.119 0.968 . . . . 0.0 113.271 178.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 34.5 t80 -70.13 135.3 49.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.51 139.32 47.53 Favored 'General case' 0 C--O 1.23 0.069 0 O-C-N 122.001 -0.437 . . . . 0.0 112.168 -174.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.52 152.45 24.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.296 175.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 10.5 ptmm? . . . . . 0 CA--C 1.53 0.191 0 C-N-CA 123.839 0.856 . . . . 0.0 110.624 176.471 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.91 164.26 25.31 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 124.005 3.137 . . . . 0.0 111.792 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -129.88 142.33 50.68 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 102.006 -3.331 . . . . 0.0 102.006 171.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.274 0.6 OUTLIER -81.95 137.15 35.21 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -174.227 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -78.11 135.1 37.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.501 ' HZ1' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -128.49 151.19 49.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -178.703 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.2 pp -151.38 166.48 30.91 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.489 0.662 . . . . 0.0 110.962 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 45.2 t -159.81 163.0 34.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.781 0.832 . . . . 0.0 109.359 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -57.52 124.74 20.04 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 172.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 34.0 t -75.1 149.03 39.22 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -170.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.271 0.6 OUTLIER -116.86 9.67 13.92 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 170.788 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.05 163.39 22.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.204 1.002 . . . . 0.0 111.816 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -92.5 -3.05 55.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.513 -178.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -155.14 174.61 14.96 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 123.572 0.749 . . . . 0.0 110.491 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.44 18.78 1.88 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.045 0.938 . . . . 0.0 109.855 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.221 -1.371 . . . . 0.0 110.918 -177.414 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.455 -0.752 0 N-CA-C 111.101 -0.384 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -156.66 159.69 38.65 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.746 0.418 . . . . 0.0 110.721 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.15 163.26 28.22 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.781 0.433 . . . . 0.0 111.209 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -71.53 -9.59 58.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.77 148.4 12.49 Favored Pre-proline 0 CA--C 1.53 0.21 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.162 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.13 -18.73 45.55 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.554 2.836 . . . . 0.0 112.085 172.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -87.6 153.32 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.5 tt -143.08 154.04 43.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.246 1.018 . . . . 0.0 108.907 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 77.3 mmm -132.01 141.73 49.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.62 0.368 . . . . 0.0 111.292 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.11 150.6 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -141.36 173.45 11.48 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 -175.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.56 8.59 80.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.849 -0.5 . . . . 0.0 111.849 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 29.06 0.19 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.696 0.798 . . . . 0.0 112.248 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.14 -37.3 86.98 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 -67.35 149.61 50.08 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 33.8 t -70.45 -9.75 57.32 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.301 0.64 . . . . 0.0 112.582 -175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -71.4 -21.21 62.03 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 121.897 -0.502 . . . . 0.0 111.621 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 55.1 mmm -82.29 145.93 29.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.078 -0.389 . . . . 0.0 110.696 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -160.27 156.07 25.82 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.256 1.022 . . . . 0.0 108.452 177.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.8 p -59.99 -29.23 68.32 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -70.97 -42.44 69.72 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.201 0.455 . . . . 0.0 111.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -75.98 -42.7 47.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -175.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.5 t -69.45 -42.24 80.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.409 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 2.3 t80 -76.9 -32.88 57.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -169.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -74.17 -29.36 61.74 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 120.012 1.278 . . . . 0.0 109.897 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -59.67 -59.2 4.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.552 0.7 OUTLIER -76.65 -3.48 38.09 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 174.35 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . 0.443 ' HG ' HG11 ' A' ' 406' ' ' VAL . 33.1 t -74.66 -37.77 62.63 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.873 -0.517 . . . . 0.0 111.323 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.37 -16.99 51.81 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -9.81 59.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 117.118 2.266 . . . . 0.0 117.118 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -174.03 -128.99 1.13 Allowed Glycine 0 CA--C 1.525 0.666 0 O-C-N 121.903 -0.498 . . . . 0.0 112.347 -175.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -138.08 127.0 23.98 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.563 0.745 . . . . 0.0 109.035 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.443 HG11 ' HG ' ' A' ' 401' ' ' CYS . 1.0 OUTLIER -114.07 165.57 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -175.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -122.35 -57.21 1.77 Allowed 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -154.52 162.55 41.09 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -142.8 152.54 17.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 124.474 1.11 . . . . 0.0 109.793 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -157.47 140.73 15.42 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -90.17 167.56 12.62 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 ptp -142.91 133.58 25.2 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 121.359 0.599 . . . . 0.0 111.7 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -5.66 54.62 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.648 1.179 . . . . 0.0 112.338 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 83.1 p -77.74 -1.23 30.24 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -140.24 156.37 69.98 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 124.452 1.101 . . . . 0.0 109.093 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -67.15 -12.57 36.49 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.181 2.587 . . . . 0.0 111.739 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.9 97.36 0.11 Allowed Glycine 0 C--N 1.337 0.621 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.33 159.82 37.88 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.963 0.505 . . . . 0.0 110.372 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -154.54 155.67 35.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.971 0.415 . . . . 0.0 111.048 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 43.7 ttm -108.98 148.76 30.24 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.479 1.112 . . . . 0.0 109.008 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.0 t -138.7 153.26 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 123.308 0.643 . . . . 0.0 111.431 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -140.8 132.52 27.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.332 0.515 . . . . 0.0 110.797 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 9.7 ptp -162.56 176.14 10.71 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.353 1.061 . . . . 0.0 110.535 -172.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.46 120.81 12.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 174.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -72.36 -33.47 67.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.42 -86.55 0.02 OUTLIER Glycine 0 CA--C 1.517 0.172 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.264 72.9 m-85 -74.78 -25.57 59.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -86.78 -37.19 18.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.905 -175.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.3 t -82.36 -32.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.339 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -69.22 -41.02 77.58 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -68.2 -38.61 82.15 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.52 0.6 . . . . 0.0 111.844 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -64.45 -35.29 80.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.277 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 51.5 mt -77.65 -15.89 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.184 0.594 . . . . 0.0 111.177 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 28.4 m -93.67 -19.47 21.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -133.67 -20.46 2.03 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 116.558 2.059 . . . . 0.0 116.558 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.36 -12.88 2.39 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 120.795 1.634 . . . . 0.0 114.648 -172.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.521 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.47 100.96 2.32 Favored 'General case' 0 C--O 1.201 -1.471 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -168.309 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.587 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 10.9 m-80 78.63 22.05 0.72 Allowed 'General case' 0 N--CA 1.484 1.256 0 O-C-N 117.614 -3.179 . . . . 0.0 114.051 -161.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -74.16 162.8 28.59 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.428 -0.795 . . . . 0.0 109.706 167.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -80.22 142.45 34.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 172.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.6 ttt -158.64 134.28 8.81 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.352 45.6 m-85 58.39 11.04 1.5 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 97.44 3.71 58.5 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -128.96 -165.01 1.45 Allowed 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.184 0.994 . . . . 0.0 108.933 176.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -126.1 149.88 48.6 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 122.683 0.393 . . . . 0.0 111.31 -177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.2 ptm -124.62 75.57 1.42 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.231 1.012 . . . . 0.0 109.637 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.587 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.8 m120 -51.98 127.06 20.2 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 115.618 -2.134 . . . . 0.0 112.821 -174.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.521 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.439 2.1 t -126.29 152.17 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 113.21 -3.396 . . . . 0.0 115.952 169.161 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.46 167.27 17.73 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.028 1.331 . . . . 0.0 109.069 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.94 147.48 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 40.4 t -87.49 159.78 18.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.901 0.481 . . . . 0.0 111.865 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -100.5 -8.04 23.55 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.377 0.271 . . . . 0.0 110.6 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -76.79 150.54 81.67 Favored Pre-proline 0 N--CA 1.455 -0.202 0 C-N-CA 123.477 0.711 . . . . 0.0 111.104 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.99 -36.11 1.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.558 2.839 . . . . 0.0 112.178 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.37 157.68 9.24 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.198 0.599 . . . . 0.0 110.726 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.02 142.96 13.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 78.7 mtp -115.27 126.78 27.43 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 122.072 0.149 . . . . 0.0 111.346 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.88 168.28 23.76 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.79 2.994 . . . . 0.0 109.875 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.47 -135.3 4.77 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -72.33 157.35 37.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.17 0.588 . . . . 0.0 109.663 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.6 p -148.79 177.88 9.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.593 0.357 . . . . 0.0 110.72 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -122.17 4.47 9.79 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 81.98 -177.54 53.8 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 54.8 mt -144.65 168.14 20.89 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 124.057 0.943 . . . . 0.0 109.911 -178.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.3 pm0 -66.16 -31.1 71.74 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.203 0.601 . . . . 0.0 110.447 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -120.51 12.11 11.5 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -155.95 172.11 33.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 112.044 -0.423 . . . . 0.0 112.044 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.9 m -100.42 -18.39 16.74 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 10.6 p -127.13 154.31 44.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.306 0.643 . . . . 0.0 111.457 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.0 p -83.64 -3.55 57.83 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 122.777 0.431 . . . . 0.0 111.424 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.25 2.3 t80 -121.11 150.2 41.6 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -175.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -152.76 151.47 30.53 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.734 0.302 . . . . 0.0 111.131 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -119.36 138.04 53.33 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.07 5.01 4.14 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 115.969 1.841 . . . . 0.0 115.969 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 46.7 t -66.63 -28.48 68.51 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.746 0.418 . . . . 0.0 111.449 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -95.98 -6.66 38.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.892 0.477 . . . . 0.0 111.32 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.2 t -80.45 146.99 31.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.602 0.361 . . . . 0.0 111.201 -178.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -91.28 4.43 52.35 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.48 0.312 . . . . 0.0 111.106 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -63.93 -22.91 67.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.792 0.269 . . . . 0.0 111.017 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -60.81 134.16 56.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.501 0.72 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.7 tpt85 -80.96 -33.62 33.76 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -176.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.302 56.4 m-85 -97.99 11.95 35.84 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.685 2.476 . . . . 0.0 117.685 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 79.9 p -73.64 -10.35 59.61 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -172.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.47 147.81 61.42 Favored Pre-proline 0 N--CA 1.461 0.117 0 N-CA-C 115.405 1.631 . . . . 0.0 115.405 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.77 -31.91 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.035 2.49 . . . . 0.0 112.392 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -79.15 -23.58 43.87 Favored 'General case' 0 CA--C 1.528 0.104 0 O-C-N 122.352 -0.218 . . . . 0.0 111.03 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -83.53 -41.34 18.06 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -61.33 -20.3 62.79 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.673 0.389 . . . . 0.0 111.874 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.75 -17.86 57.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -123.96 9.0 8.71 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -64.06 152.36 40.54 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.442 0.564 . . . . 0.0 111.998 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -143.85 125.97 15.49 Favored 'General case' 0 C--O 1.23 0.076 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.1 mm -143.38 -20.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.441 0.696 . . . . 0.0 110.838 -175.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 12.0 pm0 -65.4 160.67 21.44 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.513 0.725 . . . . 0.0 111.608 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 51.68 50.04 7.89 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 124.436 1.094 . . . . 0.0 113.893 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.67 146.6 84.54 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.634 2.223 . . . . 0.0 109.291 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 17.0 t -159.73 -157.91 0.61 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -175.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -83.74 0.6 46.52 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.319 0.648 . . . . 0.0 110.88 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 4.5 t -88.8 139.4 17.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 C-N-CA 123.337 0.655 . . . . 0.0 112.309 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.19 156.63 33.31 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.458 0.703 . . . . 0.0 109.556 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -122.98 141.5 51.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -134.08 159.1 41.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.624 0.726 . . . . 0.0 110.706 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -151.51 163.37 39.16 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 103.093 -2.928 . . . . 0.0 103.093 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.48 57.33 4.42 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.551 0.341 . . . . 0.0 111.271 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -127.92 150.32 73.19 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.589 0.356 . . . . 0.0 111.1 177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.37 153.36 34.66 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.7 2.933 . . . . 0.0 112.993 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 60.6 mt -68.54 -16.72 63.97 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.433 0.693 . . . . 0.0 112.506 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -122.81 23.84 9.28 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.838 0.855 . . . . 0.0 111.329 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.3 p -65.85 -12.01 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.576 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.35 -176.86 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -166.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.576 ' H ' HG21 ' A' ' 510' ' ' THR . 22.6 pt-20 -23.39 -41.49 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.0 -48.55 78.19 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 117.107 -1.425 . . . . 0.0 114.082 172.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -87.78 -27.59 22.22 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 122.481 2.4 . . . . 0.0 106.919 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -63.28 -37.74 88.43 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.308 -0.957 . . . . 0.0 113.521 175.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -73.47 -43.34 60.41 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.35 -21.17 56.47 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 119.99 -0.684 . . . . 0.0 111.823 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.7 mt -74.93 -37.6 41.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 174.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.5 m -66.22 -37.07 84.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.052 -0.405 . . . . 0.0 110.618 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -70.61 -26.86 63.69 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -74.98 -26.31 59.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.494 0.318 . . . . 0.0 110.831 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 82.2 mt -98.47 -5.26 32.72 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.05 0.54 . . . . 0.0 111.509 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.83 -1.37 54.25 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.406 0.527 . . . . 0.0 112.861 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.9 m -77.87 159.48 4.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 117.734 0.767 . . . . 0.0 112.527 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -69.38 146.14 52.34 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 123.014 0.526 . . . . 0.0 111.221 -178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -74.73 154.43 87.25 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.727 0.811 . . . . 0.0 111.44 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.76 157.19 61.24 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.382 2.722 . . . . 0.0 110.33 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -90.16 -17.15 28.13 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.1 t -158.88 155.21 27.33 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.653 0.381 . . . . 0.0 110.624 177.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.7 m -142.84 153.83 17.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 C-N-CA 123.637 0.775 . . . . 0.0 113.039 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -150.19 142.29 24.03 Favored 'General case' 0 N--CA 1.458 -0.055 0 C-N-CA 123.479 0.712 . . . . 0.0 109.71 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.39 150.79 22.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -155.81 178.83 9.82 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 94.5 p -141.66 169.78 16.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.476 0.71 . . . . 0.0 110.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 116.91 -16.91 13.29 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 123.937 0.78 . . . . 0.0 111.959 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -84.71 -24.61 28.83 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 117.522 0.661 . . . . 0.0 112.285 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.6 t -163.13 155.41 18.29 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.937 0.495 . . . . 0.0 110.153 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.79 -7.64 33.18 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.598 0.359 . . . . 0.0 110.722 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.13 -31.67 44.21 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 95.8 p -165.47 170.44 14.43 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.051 0.453 . . . . 0.0 111.724 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 47.5 t -86.26 163.82 17.52 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.6 0.76 . . . . 0.0 110.16 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 68.4 m -141.99 161.38 38.12 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.978 0.911 . . . . 0.0 108.68 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.44 43.56 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 119.888 -1.149 . . . . 0.0 113.309 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -118.77 158.35 25.75 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.782 0.833 . . . . 0.0 110.229 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 84.3 mt -141.1 157.92 44.64 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 124.594 1.157 . . . . 0.0 108.645 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -147.62 150.27 34.1 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.359 0.527 . . . . 0.0 111.567 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.7 m-90 -126.48 164.23 21.62 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.514 1.126 . . . . 0.0 112.202 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.01 -11.05 60.6 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.0 t -156.01 162.04 40.38 Favored 'General case' 0 C--N 1.339 0.138 0 O-C-N 121.536 -0.728 . . . . 0.0 111.57 -178.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -65.55 -31.82 73.07 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 122.887 0.475 . . . . 0.0 110.333 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 79.1 p -76.42 -28.46 56.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.215 0.206 . . . . 0.0 110.728 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -73.6 -34.44 65.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.62 -30.62 61.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 175.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 49.7 tp -74.92 -38.82 61.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 122.331 0.252 . . . . 0.0 111.334 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -74.1 -40.08 62.95 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.844 -0.535 . . . . 0.0 110.044 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.8 -24.67 62.61 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -68.23 -34.87 77.03 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 171.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -68.97 -32.43 73.34 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.491 -0.616 . . . . 0.0 112.302 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.287 8.2 m-85 -95.59 -9.7 31.53 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.92 -11.19 11.54 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-N 119.082 0.856 . . . . 0.0 113.254 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -74.38 138.68 43.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 119.153 0.888 . . . . 0.0 109.331 178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 60.36 22.51 12.03 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.581 0.752 . . . . 0.0 112.484 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 29.1 t80 -81.54 145.77 30.5 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -73.8 144.58 45.51 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.78 -0.575 . . . . 0.0 111.869 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 65.5 mtm -83.54 152.54 24.84 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 172.04 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.1 p90 . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.87 162.08 43.02 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.466 2.777 . . . . 0.0 111.031 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.93 142.34 50.66 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.47 131.18 44.34 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -174.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.75 147.99 24.94 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.277 1.031 . . . . 0.0 109.347 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -140.8 154.11 46.1 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.793 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -158.59 161.37 37.24 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 27.0 p -158.36 174.82 14.55 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.495 0.718 . . . . 0.0 110.254 -176.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -59.73 124.26 19.56 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 30.2 t -85.67 150.35 24.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -110.38 9.25 23.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.66 163.37 16.51 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.609 0.764 . . . . 0.0 111.827 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 -89.58 -3.08 58.46 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.98 178.02 4.11 Favored 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 123.415 0.686 . . . . 0.0 110.142 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -136.72 18.83 3.06 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.74 0.416 . . . . 0.0 111.568 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.501 -1.238 . . . . 0.0 110.526 179.946 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 N--CA 1.454 -0.809 0 CA-C-O 120.831 0.263 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -155.38 160.33 40.61 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 110.893 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.98 161.41 31.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.828 0.451 . . . . 0.0 111.134 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -70.6 -5.08 26.61 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.55 145.68 10.97 Favored Pre-proline 0 N--CA 1.456 -0.127 0 O-C-N 122.183 -0.323 . . . . 0.0 111.446 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.78 -18.69 62.03 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.672 2.915 . . . . 0.0 111.626 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 5.3 t -94.57 153.68 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 C-N-CA 123.607 0.763 . . . . 0.0 112.194 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -141.09 153.52 45.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.271 1.028 . . . . 0.0 108.789 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 74.1 mmm -130.39 133.73 46.6 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 122.91 0.484 . . . . 0.0 111.695 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.75 151.78 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.22 177.99 8.22 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 105.38 -2.082 . . . . 0.0 105.38 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 82.3 12.04 81.25 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 112.034 -0.427 . . . . 0.0 112.034 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 48.8 mt -78.24 26.26 0.21 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.514 0.657 . . . . 0.0 112.203 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -64.37 -37.89 89.1 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -176.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . 0.4 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.6 pm0 -67.07 150.42 49.22 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.182 0.515 . . . . 0.0 111.055 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -70.04 -8.71 51.52 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.666 0.786 . . . . 0.0 112.974 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -76.85 -13.88 59.95 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.73 0.412 . . . . 0.0 111.676 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 56.4 mmm -85.07 152.15 23.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.963 0.411 . . . . 0.0 111.099 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.73 155.37 23.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 175.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . 0.421 ' HA ' ' CE1' ' A' ' 411' ' ' PHE . 24.2 p -57.42 -32.0 66.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -175.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.06 -47.97 63.96 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 175.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.9 mtt85 -70.55 -39.11 74.17 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 116.821 -0.172 . . . . 0.0 110.972 -171.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.74 -46.35 74.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -77.68 -28.65 51.17 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.712 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -77.31 -29.11 53.51 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.392 0.997 . . . . 0.0 110.097 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.93 -56.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.555 2.3 p90 -76.66 -3.21 36.65 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 173.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.01 -36.87 67.08 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.866 -0.521 . . . . 0.0 110.559 177.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.15 -11.67 22.11 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.779 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -89.22 -3.79 58.44 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.95 -169.82 41.05 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 118.795 0.725 . . . . 0.0 112.91 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -78.46 114.28 17.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 2.5 m -114.09 165.49 9.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -127.87 -59.49 1.19 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -154.42 167.81 28.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -172.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.1 150.42 15.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 124.827 1.251 . . . . 0.0 109.84 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -151.54 128.78 11.21 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 123.353 0.661 . . . . 0.0 110.805 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . 0.421 ' CE1' ' HA ' ' A' ' 393' ' ' CYS . 3.3 m-85 -82.84 156.95 23.35 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 117.396 2.369 . . . . 0.0 117.396 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.17 127.77 37.77 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.712 0.405 . . . . 0.0 110.846 175.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . 0.512 ' H ' ' CD ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.21 -29.14 42.66 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.849 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 52.2 p -102.02 -19.51 15.17 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -80.5 154.27 73.9 Favored Pre-proline 0 CA--C 1.528 0.129 0 CA-C-N 118.456 0.571 . . . . 0.0 110.047 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.84 -15.87 48.39 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.085 2.523 . . . . 0.0 111.136 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 166.66 98.19 0.12 Allowed Glycine 0 C--N 1.336 0.538 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 176.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.17 37.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.334 0.654 . . . . 0.0 110.209 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.75 148.85 19.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 62.8 mtp -85.03 150.77 24.64 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.348 1.059 . . . . 0.0 109.037 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.89 146.39 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 C-N-CA 123.48 0.712 . . . . 0.0 110.414 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . 0.411 ' C ' ' HG3' ' A' ' 423' ' ' MET . 71.4 tt0 -129.42 129.81 45.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.374 0.534 . . . . 0.0 109.888 176.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 423' ' ' MET . . . . . 0.411 ' HG3' ' C ' ' A' ' 422' ' ' GLU . 49.9 mtp -150.77 167.68 26.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.335 1.054 . . . . 0.0 109.389 -169.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.76 122.38 17.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 170.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -72.34 -33.21 67.12 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -167.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.45 -89.57 0.01 OUTLIER Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.56 -25.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -89.52 -35.15 16.1 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.99 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 81.6 t -85.94 -26.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.345 0.401 0 C-N-CA 118.217 -1.393 . . . . 0.0 109.025 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -68.42 -50.06 55.51 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -66.91 -33.18 75.02 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 120.266 -0.574 . . . . 0.0 112.262 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.23 -36.72 82.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.841 0.746 . . . . 0.0 110.2 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.1 mt -79.21 -8.1 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.55 0.74 . . . . 0.0 111.184 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.7 m -100.08 -21.26 15.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -124.53 -27.77 3.68 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 -169.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.7 mt -134.52 -10.63 2.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.483 1.492 . . . . 0.0 114.711 -173.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.557 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -71.86 100.77 2.48 Favored 'General case' 0 C--O 1.204 -1.335 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -169.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.578 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 13.4 m-80 76.73 22.16 1.17 Allowed 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 123.381 2.81 . . . . 0.0 112.811 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.52 161.3 18.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 168.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.271 37.6 m-85 -74.47 138.4 43.2 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' MET . . . . . 0.448 ' HE2' ' CE2' ' A' ' 442' ' ' PHE . 19.0 ttt -157.11 142.53 17.37 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.386 0.674 . . . . 0.0 109.603 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.448 ' CE2' ' HE2' ' A' ' 441' ' ' MET . 61.0 m-85 59.34 17.55 5.95 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.42 85.31 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -173.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -133.32 -159.35 0.96 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.773 1.629 . . . . 0.0 108.598 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -128.62 151.02 49.96 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.551 0.341 . . . . 0.0 110.779 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -129.25 82.58 2.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.578 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.2 m120 -58.69 127.4 31.99 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 115.98 -1.962 . . . . 0.0 113.343 -172.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.557 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.409 2.1 t -129.94 150.93 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 113.593 -3.243 . . . . 0.0 115.953 168.699 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.3 t -161.49 167.7 25.02 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.585 1.154 . . . . 0.0 109.27 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -72.31 150.86 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 41.6 t -90.71 166.56 13.07 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.334 0.653 . . . . 0.0 111.492 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -106.13 -6.42 18.61 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.621 0.368 . . . . 0.0 110.455 175.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -77.74 152.03 80.13 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 123.98 0.912 . . . . 0.0 111.613 -178.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.52 -38.89 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 123.14 2.56 . . . . 0.0 112.045 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.55 159.38 10.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.608 0.763 . . . . 0.0 110.479 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 64.9 mt -80.51 128.87 38.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 24.8 mmm -94.78 140.61 22.62 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.361 0.265 . . . . 0.0 111.292 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -73.38 158.18 48.59 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 123.318 2.679 . . . . 0.0 109.065 172.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 160.33 -133.95 3.45 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.694 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -72.31 167.8 19.69 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.441 0.696 . . . . 0.0 111.419 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.7 p -154.83 167.78 29.09 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.738 0.815 . . . . 0.0 109.785 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.78 -1.61 0.98 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.62 -171.14 54.41 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.5 mt -142.26 159.96 41.19 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.138 0.975 . . . . 0.0 109.229 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.55 -19.34 62.9 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -120.44 25.5 9.76 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -160.66 -159.15 9.71 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.7 t -133.0 -15.95 2.56 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 80.1 m -127.04 143.69 51.22 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.595 0.358 . . . . 0.0 111.441 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 71.9 p -93.84 3.47 55.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.348 0.659 . . . . 0.0 110.894 175.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -142.74 149.57 38.92 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.115 1.366 . . . . 0.0 114.254 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . 0.439 ' HD2' ' H ' ' A' ' 473' ' ' ASP . 54.5 tptt -154.61 152.88 30.53 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 117.994 0.361 . . . . 0.0 111.454 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . 0.439 ' H ' ' HD2' ' A' ' 472' ' ' LYS . 5.8 t0 -124.24 128.88 49.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.203 1.401 . . . . 0.0 112.45 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.282 3.3 m-85 -91.22 -6.64 53.07 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -177.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.7 t -75.09 -33.52 61.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -81.22 -17.07 50.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.575 0.35 . . . . 0.0 110.468 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 54.7 m -91.31 -3.81 56.47 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 60.91 -1.93 0.22 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.755 1.222 . . . . 0.0 113.204 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -64.73 -22.36 66.96 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.097 0.559 . . . . 0.0 112.064 -176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -59.42 115.6 3.38 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -81.02 -24.14 38.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.331 -0.395 . . . . 0.0 112.015 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.301 62.5 m-85 -97.94 17.44 18.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -64.1 -20.05 65.69 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.04 154.1 70.03 Favored Pre-proline 0 C--O 1.232 0.156 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 177.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -64.1 -23.49 67.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.087 2.525 . . . . 0.0 111.679 177.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -75.76 -29.46 58.82 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.331 -0.231 . . . . 0.0 110.675 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -82.0 -38.95 24.3 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.56 -19.67 65.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.667 0.387 . . . . 0.0 111.81 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.82 -16.73 54.91 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.0 0.37 8.52 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -65.33 157.25 29.66 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.289 178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.71 118.28 10.96 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.93 41.85 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.437 0.695 . . . . 0.0 111.042 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -64.68 167.92 6.73 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.904 -0.498 . . . . 0.0 110.092 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -57.6 151.12 42.23 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 122.693 0.397 . . . . 0.0 110.777 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.12 162.27 36.42 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 123.479 2.786 . . . . 0.0 110.838 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 33.2 t -158.05 -176.86 6.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -83.68 -3.72 57.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -88.13 146.42 6.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 123.621 0.768 . . . . 0.0 112.572 175.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 8.8 tp -137.38 152.23 49.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.027 0.531 . . . . 0.0 109.833 -178.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -123.9 147.75 47.41 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.838 0.855 . . . . 0.0 109.131 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -142.29 161.53 37.79 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.689 0.757 . . . . 0.0 109.983 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -153.7 166.12 33.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 58.25 57.44 3.95 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.646 0.378 . . . . 0.0 111.434 -174.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -124.86 154.9 70.86 Favored Pre-proline 0 CA--C 1.533 0.299 0 C-N-CA 123.629 0.772 . . . . 0.0 109.935 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.41 156.74 64.91 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.202 1.935 . . . . 0.0 110.305 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.42 -16.53 63.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -173.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -115.36 25.14 11.06 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.5 0.72 . . . . 0.0 111.385 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.85 -14.24 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.563 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.96 -177.25 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -164.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.563 ' H ' HG23 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.53 -39.4 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.1 mt-10 -59.27 -45.88 90.03 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 116.956 -1.497 . . . . 0.0 114.77 172.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -88.22 -27.18 21.95 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 122.852 2.569 . . . . 0.0 106.865 -174.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -65.77 -36.08 82.52 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.426 -0.909 . . . . 0.0 113.308 175.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -74.08 -44.26 54.68 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -76.59 -25.0 53.47 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.755 -0.778 . . . . 0.0 111.739 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.2 mt -72.22 -40.56 65.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 O-C-N 121.75 -0.594 . . . . 0.0 110.027 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 74.3 m -65.31 -30.24 71.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.23 0.468 . . . . 0.0 111.294 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -66.91 -39.44 87.4 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.915 0.388 . . . . 0.0 112.026 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -73.42 -6.75 48.29 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.04 -3.73 12.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.865 0.466 . . . . 0.0 111.778 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.88 -16.71 3.15 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.995 0.807 . . . . 0.0 113.931 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.5 m -77.39 156.8 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 118.461 1.13 . . . . 0.0 108.771 177.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -70.83 150.33 45.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.087 0.47 . . . . 0.0 111.496 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -76.19 157.41 83.1 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.311 0.644 . . . . 0.0 110.065 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.41 151.09 83.93 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 122.959 2.44 . . . . 0.0 110.549 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.0 t -83.53 -22.98 32.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -148.67 150.61 33.51 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.282 0.633 . . . . 0.0 110.665 178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.8 m -144.52 156.1 14.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 C-N-CA 123.655 0.782 . . . . 0.0 112.676 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -154.71 144.67 21.74 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.529 0.732 . . . . 0.0 109.505 175.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.96 152.48 28.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -155.51 -177.75 6.78 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.994 1.849 . . . . 0.0 115.994 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.1 p -143.49 -170.34 3.27 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.211 1.004 . . . . 0.0 109.846 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.56 -9.22 62.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.758 0.694 . . . . 0.0 112.254 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -94.43 -26.91 16.3 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 117.54 0.67 . . . . 0.0 111.648 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.4 t -164.59 156.94 16.44 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.235 0.614 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.99 -8.03 31.54 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.842 0.457 . . . . 0.0 110.787 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.26 -33.64 37.7 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 28.0 t -164.94 157.43 16.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.63 0.252 . . . . 0.0 111.651 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 95.3 p -82.9 176.24 9.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.454 0.702 . . . . 0.0 111.051 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.0 t -149.05 162.71 39.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.095 0.958 . . . . 0.0 108.445 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.31 -174.45 47.0 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.124 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.52 160.18 23.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.598 0.759 . . . . 0.0 110.394 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.5 mt -139.77 161.33 37.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.113 1.365 . . . . 0.0 108.347 178.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -151.38 148.39 28.07 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.248 -0.282 . . . . 0.0 111.573 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 22.2 m-90 -129.07 173.67 10.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.877 1.271 . . . . 0.0 111.915 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -7.99 54.74 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 46.8 t -162.03 165.06 27.83 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.193 -0.317 . . . . 0.0 111.295 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.92 -37.62 86.54 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 122.968 0.507 . . . . 0.0 110.269 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.2 p -72.26 -27.26 62.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -71.8 -39.75 69.67 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 175.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.6 -27.14 60.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 62.4 tp -77.89 -40.35 40.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -178.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -70.96 -36.76 72.69 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.65 -23.78 59.91 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -44.57 76.83 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -61.55 -37.16 93.72 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-O 119.668 -0.518 . . . . 0.0 112.113 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.292 25.2 m-85 -84.95 -13.33 51.05 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.9 mt -110.81 -10.15 14.45 Favored 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -72.62 144.19 47.91 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.274 0.943 . . . . 0.0 108.829 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 58.77 18.96 6.44 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.952 0.901 . . . . 0.0 112.852 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.45 131.78 51.29 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -77.38 124.83 28.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 121.866 -0.522 . . . . 0.0 110.747 -177.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.0 mtm -83.54 152.57 24.82 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.287 0.235 . . . . 0.0 111.406 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.483 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.6 p90 . . . . . 0 C--O 1.231 0.124 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.99 167.41 27.12 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.889 3.059 . . . . 0.0 111.266 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -129.87 142.44 50.67 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 103.177 -2.897 . . . . 0.0 103.177 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.271 0.7 OUTLIER -81.63 141.14 33.95 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -178.018 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.8 tt -86.46 152.52 22.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.954 1.302 . . . . 0.0 109.455 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.0 pttp -140.44 153.53 46.32 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.159 0.436 . . . . 0.0 110.697 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.46 161.71 38.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.191 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.5 p -161.6 171.52 17.89 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.971 0.909 . . . . 0.0 110.908 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -55.67 125.33 20.67 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 31.2 t -81.65 150.16 28.19 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -171.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -113.72 9.3 17.71 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.91 163.15 20.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.831 0.852 . . . . 0.0 111.542 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -89.41 -7.27 55.51 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.347 0.659 . . . . 0.0 111.776 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -172.49 172.21 4.41 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.668 0.787 . . . . 0.0 110.273 176.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -140.92 20.31 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.243 0.617 . . . . 0.0 111.793 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.2 t . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.691 -1.147 . . . . 0.0 110.499 179.878 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo . . . . . 0 N--CA 1.454 -0.849 0 CA-C-O 120.6 0.167 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -157.72 153.52 26.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.801 0.44 . . . . 0.0 110.701 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -77.8 157.78 29.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.468 0.307 . . . . 0.0 110.3 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 8.6 p30 -84.02 6.57 21.56 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 115.886 1.809 . . . . 0.0 115.886 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -153.72 143.98 15.62 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 119.387 -0.339 . . . . 0.0 111.105 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.22 -3.03 3.56 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.387 3.391 . . . . 0.0 113.455 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.06 151.01 28.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -122.37 153.54 38.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.526 1.531 . . . . 0.0 108.291 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.7 tpt -135.13 128.41 32.08 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 117.773 0.26 . . . . 0.0 110.64 -176.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -122.4 153.23 26.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -175.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -142.98 175.91 9.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.365 -2.458 . . . . 0.0 104.365 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.64 15.91 67.17 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 37.7 mt -86.46 19.6 2.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.389 0.675 . . . . 0.0 111.557 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.321 8.4 p30 -73.48 32.29 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 117.285 2.328 . . . . 0.0 117.285 -173.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -140.55 154.54 46.57 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 110.29 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 86.8 p -66.05 -11.45 48.44 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -78.63 -9.49 59.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.203 0.456 . . . . 0.0 111.635 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 60.1 mmm -97.32 149.75 21.74 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 117.936 0.334 . . . . 0.0 110.224 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -161.55 154.86 21.2 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 22.3 p -59.18 -35.8 74.19 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.16 -38.71 78.89 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -74.4 -51.33 15.3 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.98 -33.9 63.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.211 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.443 ' HA ' ' CE1' ' A' ' 400' ' ' PHE . 5.5 t80 -75.66 -30.64 59.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.584 -174.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -74.83 -32.46 61.95 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.443 1.019 . . . . 0.0 110.068 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 30.0 t -57.52 -57.7 9.13 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 397' ' ' PHE 0.49 2.6 p90 -76.54 -5.08 46.08 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 117.646 2.462 . . . . 0.0 117.646 174.556 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . 0.41 ' HA ' HG12 ' A' ' 406' ' ' VAL . 40.5 t -74.32 -34.54 63.48 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 118.198 0.453 . . . . 0.0 111.133 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.41 -16.46 46.9 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.959 177.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . 0.252 55.2 m-85 -85.08 -5.28 59.35 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 118.298 2.703 . . . . 0.0 118.298 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.91 -167.07 39.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.475 -0.869 . . . . 0.0 113.303 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -84.95 120.06 26.07 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.683 0.793 . . . . 0.0 109.361 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 401' ' ' CYS . 1.4 m -113.94 165.49 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.053 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -174.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -133.36 -57.36 0.9 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -149.79 164.28 35.72 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.44 147.01 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 124.625 1.17 . . . . 0.0 109.073 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.4 130.36 11.0 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.335 0.254 . . . . 0.0 111.64 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.3 m-85 -85.0 156.08 21.29 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.9 mmt -95.75 118.02 31.63 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.534 0.733 . . . . 0.0 112.244 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -79.11 -14.35 59.18 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.914 0.485 . . . . 0.0 111.124 172.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.7 p -90.26 1.47 56.47 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.625 0.77 . . . . 0.0 111.875 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -136.06 155.21 77.76 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 123.664 0.786 . . . . 0.0 110.46 -176.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.76 -15.67 33.37 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.249 2.633 . . . . 0.0 111.624 178.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.78 95.21 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.14 159.42 36.16 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.879 0.872 . . . . 0.0 109.281 177.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.56 156.64 21.1 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 71.8 mtm -102.58 154.73 18.84 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.427 0.691 . . . . 0.0 109.997 172.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.05 124.93 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 123.314 0.646 . . . . 0.0 110.893 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -103.62 127.84 51.0 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtm -154.63 172.4 17.92 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.796 0.838 . . . . 0.0 109.85 -174.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -64.79 122.07 16.04 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -72.35 -33.47 67.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.79 -87.97 0.01 OUTLIER Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -73.01 -26.81 61.46 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 117.185 2.291 . . . . 0.0 117.185 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -85.8 -37.19 19.52 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.052 -1.059 . . . . 0.0 111.798 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.0 t -85.87 -26.22 6.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.622 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -66.42 -51.91 52.0 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.164 -0.335 . . . . 0.0 111.391 175.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -69.93 -31.15 68.77 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.38 72.66 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.915 0.78 . . . . 0.0 110.089 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -78.11 -15.48 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 123.222 0.609 . . . . 0.0 110.752 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.4 m -93.01 -18.88 22.15 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.77 -21.37 3.08 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -170.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.71 -12.34 2.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.956 1.707 . . . . 0.0 114.311 -174.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.546 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.73 100.92 2.45 Favored 'General case' 0 C--O 1.205 -1.237 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -168.172 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.559 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 15.0 m-80 77.04 21.51 1.11 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 123.159 2.709 . . . . 0.0 113.771 -161.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -78.84 161.32 26.85 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.94 -1.1 . . . . 0.0 111.155 168.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . 0.403 ' CZ ' ' HE3' ' A' ' 445' ' ' LYS . 55.7 m-85 -71.3 142.42 50.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.2 ttt -162.5 134.52 5.42 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.392 50.8 m-85 55.98 27.32 11.06 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 83.72 8.78 84.02 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -132.5 178.33 6.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.315 1.046 . . . . 0.0 109.266 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . 0.403 ' HE3' ' CZ ' ' A' ' 440' ' ' PHE . 40.1 ttmt -125.19 133.75 52.64 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 111.033 178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 63.0 mtm -80.63 -158.18 0.18 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.404 1.082 . . . . 0.0 109.046 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.559 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 37.1 t-20 -162.59 123.26 2.46 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 115.631 -2.128 . . . . 0.0 108.599 168.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.45 2.2 t -125.86 151.42 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 112.337 -3.745 . . . . 0.0 116.556 170.371 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 26.1 t -161.38 174.94 12.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.714 1.606 . . . . 0.0 107.938 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.2 p -73.95 149.36 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.3 t -84.21 158.45 21.29 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.882 0.473 . . . . 0.0 110.973 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -104.45 -1.81 26.21 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.459 -0.151 . . . . 0.0 110.692 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -86.79 146.47 41.18 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 123.176 0.59 . . . . 0.0 110.066 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.57 -31.14 4.49 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.319 2.68 . . . . 0.0 112.493 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.47 161.28 13.81 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.022 0.529 . . . . 0.0 110.382 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 79.0 mt -87.76 136.54 22.9 Favored 'Isoleucine or valine' 0 C--O 1.23 0.062 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 59.8 mmm -101.39 130.16 25.38 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.458 0.303 . . . . 0.0 110.913 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.54 171.42 18.07 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.608 2.872 . . . . 0.0 110.402 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 131.41 -125.41 4.4 Favored Glycine 0 C--N 1.336 0.551 0 N-CA-C 111.424 -0.67 . . . . 0.0 111.424 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -72.47 164.91 25.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.361 0.6 . . . . 0.0 112.21 -176.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 97.0 p -158.4 -179.16 7.84 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.154 0.981 . . . . 0.0 109.529 -177.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -140.88 161.96 36.58 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -80.65 131.69 10.67 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.4 mt -80.0 166.81 21.2 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.07 -22.57 64.0 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.248 -0.282 . . . . 0.0 111.178 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -120.52 25.83 9.54 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.154 0.582 . . . . 0.0 110.242 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.36 -163.07 14.33 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 121.859 -0.526 . . . . 0.0 112.419 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 48.4 t -133.09 -16.69 2.46 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.061 0.544 . . . . 0.0 111.551 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.5 t -127.09 145.98 50.54 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.957 0.503 . . . . 0.0 110.059 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 89.8 p -97.47 9.51 42.19 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.403 0.681 . . . . 0.0 111.628 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -136.15 147.24 47.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -157.84 154.15 27.55 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.606 0.362 . . . . 0.0 110.188 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 2.4 t0 -131.85 130.3 41.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -93.63 -8.89 39.8 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 117.252 2.315 . . . . 0.0 117.252 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 48.3 t -87.19 -32.27 19.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -79.25 3.8 16.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.568 0.747 . . . . 0.0 111.711 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 77.4 p -134.21 9.01 3.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.292 0.637 . . . . 0.0 111.767 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 62.77 -0.86 0.52 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.845 1.258 . . . . 0.0 113.986 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -59.21 -26.6 64.98 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.698 -0.626 . . . . 0.0 111.864 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -56.32 124.21 17.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.167 0.987 . . . . 0.0 109.994 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -81.02 -32.14 34.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -172.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.306 63.2 m-85 -97.92 17.1 18.99 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -69.12 -14.31 62.92 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -173.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.58 151.75 71.53 Favored Pre-proline 0 C--O 1.232 0.139 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -65.0 -23.83 60.88 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 123.02 2.48 . . . . 0.0 111.426 176.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -75.71 -29.7 59.05 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.359 0.263 . . . . 0.0 110.452 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -82.4 -41.98 19.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 174.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.83 64.81 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -80.79 -19.04 45.66 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -4.5 7.96 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -63.67 157.14 24.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.276 0.489 . . . . 0.0 110.414 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -150.44 144.83 25.66 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.4 mm -137.65 148.05 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 123.331 0.652 . . . . 0.0 110.225 -171.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -150.51 169.04 22.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.108 0.963 . . . . 0.0 110.186 178.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -62.88 155.92 69.02 Favored Pre-proline 0 N--CA 1.455 -0.213 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -62.21 145.49 96.19 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 122.521 2.147 . . . . 0.0 109.561 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.2 t -153.98 173.99 15.25 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.978 0.511 . . . . 0.0 109.653 -174.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.71 -3.06 57.47 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.268 -0.27 . . . . 0.0 110.935 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -98.38 135.86 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 64.8 mt -125.41 152.14 45.25 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.372 0.669 . . . . 0.0 109.717 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -110.51 143.59 40.64 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 173.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -131.28 157.77 42.42 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.224 0.535 . . . . 0.0 111.647 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -152.19 167.68 27.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 103.847 -2.649 . . . . 0.0 103.847 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 54.39 31.87 15.39 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -93.57 156.21 39.93 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 117.685 0.22 . . . . 0.0 110.864 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.73 151.14 57.65 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 123.326 2.684 . . . . 0.0 111.754 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.46 -16.58 63.95 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.315 0.646 . . . . 0.0 112.412 -177.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -122.67 26.42 8.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.579 0.752 . . . . 0.0 111.005 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.57 -14.22 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.572 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.3 OUTLIER -54.74 -177.39 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -165.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.572 ' H ' HG21 ' A' ' 510' ' ' THR . 84.6 tt0 -10.33 -53.74 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.176 1.79 . . . . 0.0 114.919 -174.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.5 mt-10 -61.4 -41.18 96.72 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -89.35 -27.33 20.56 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 123.262 2.755 . . . . 0.0 106.398 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -61.71 -39.96 93.37 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.875 -1.13 . . . . 0.0 113.09 174.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -70.47 -45.95 64.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -77.88 -24.95 48.33 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 119.918 -0.713 . . . . 0.0 111.468 -177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 53.2 mt -70.53 -39.14 75.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 118.867 0.758 . . . . 0.0 109.417 176.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 85.6 m -65.66 -32.8 74.56 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.98 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -70.16 -27.18 64.33 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -80.02 -9.19 59.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.273 0.229 . . . . 0.0 111.577 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.26 -5.95 14.61 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.096 0.558 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.55 -10.06 13.48 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 123.715 0.674 . . . . 0.0 113.025 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.9 m -79.82 159.03 4.46 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.102 0 CA-C-N 118.131 0.966 . . . . 0.0 112.45 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -67.59 148.44 51.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 121.179 0.514 . . . . 0.0 111.376 -176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -81.6 158.07 68.97 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.602 0.761 . . . . 0.0 110.884 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.24 170.88 12.41 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 123.864 3.043 . . . . 0.0 110.43 172.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -119.21 -17.97 8.77 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 64.5 m -147.49 146.84 29.65 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 123.187 0.595 . . . . 0.0 109.884 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.24 156.94 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -175.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -150.34 141.05 22.66 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -138.53 142.17 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -154.06 -172.79 4.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 22.8 t -136.84 -174.29 3.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.625 0.77 . . . . 0.0 110.11 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.88 -15.53 62.53 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.04 0.828 . . . . 0.0 111.758 -178.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 50.4 mmtm -88.46 -28.32 20.93 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.453 0.627 . . . . 0.0 110.742 175.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.9 t -166.31 158.93 14.4 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.76 . . . . 0.0 109.963 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -117.05 -4.19 11.5 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.441 0.696 . . . . 0.0 109.855 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -24.26 21.55 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.654 0.782 . . . . 0.0 110.637 -179.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 13.0 m -158.71 167.17 30.22 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.763 0.825 . . . . 0.0 111.073 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 46.9 t -79.61 164.13 24.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.64 0.776 . . . . 0.0 111.569 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 39.6 t -151.95 150.42 30.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.479 1.111 . . . . 0.0 109.376 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 170.56 -173.6 44.43 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.815 -178.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -112.05 157.66 20.5 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 123.318 0.647 . . . . 0.0 110.17 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 28.2 tp -146.32 151.74 38.01 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -147.04 149.25 32.73 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.7 m-90 -121.38 172.0 8.36 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.491 1.516 . . . . 0.0 112.536 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -74.99 -11.07 60.03 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.612 0.365 . . . . 0.0 111.137 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -156.72 158.96 37.86 Favored 'General case' 0 C--O 1.232 0.135 0 O-C-N 121.629 -0.669 . . . . 0.0 111.375 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.5 -26.25 62.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.537 0.335 . . . . 0.0 110.851 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.1 p -78.64 -25.53 45.01 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.75 -35.36 70.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 175.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.4 -28.55 59.48 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.755 -0.202 . . . . 0.0 110.665 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 39.6 tp -72.79 -44.02 62.06 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 117.875 0.307 . . . . 0.0 111.131 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -72.72 -39.48 66.89 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.904 -0.498 . . . . 0.0 109.947 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.47 -26.92 65.73 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 176.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.23 -32.39 72.56 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 172.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.39 -41.48 99.76 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.265 10.5 m-85 -89.05 -18.79 26.59 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.743 2.868 . . . . 0.0 118.743 178.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.81 -16.68 15.33 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.754 0.706 . . . . 0.0 112.323 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -73.82 143.81 45.78 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 119.317 0.962 . . . . 0.0 108.846 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.85 18.45 2.99 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.516 1.126 . . . . 0.0 112.966 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.264 43.8 t80 -72.88 138.55 46.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -73.86 134.03 43.24 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.131 -0.356 . . . . 0.0 111.813 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.6 mtm -84.58 152.6 23.75 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 122.679 0.392 . . . . 0.0 111.663 176.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.168 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 170.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.7 p90 . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -74.59 163.51 35.79 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.663 2.909 . . . . 0.0 111.238 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -129.91 142.33 50.67 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 174.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.7 OUTLIER -81.94 138.7 34.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -177.559 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.8 tt -79.67 152.29 30.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.528 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -140.64 153.5 46.05 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.902 0.319 . . . . 0.0 110.665 179.136 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.33 166.33 33.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.784 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 43.1 t -155.92 160.03 39.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.91 0.884 . . . . 0.0 109.761 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -57.37 119.2 6.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.9 t -76.14 148.15 38.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -169.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.8 t -114.14 11.77 17.66 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 169.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.6 163.04 22.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.887 0.875 . . . . 0.0 111.942 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -93.53 -3.14 53.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.742 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -153.33 170.56 20.34 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.539 0.736 . . . . 0.0 110.752 -177.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.34 23.49 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.051 0.94 . . . . 0.0 109.873 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.369 -1.3 . . . . 0.0 110.61 -176.116 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.455 -0.776 0 N-CA-C 111.08 -0.392 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -156.01 156.51 34.56 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.796 0.439 . . . . 0.0 110.564 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.05 160.68 30.94 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.879 0.472 . . . . 0.0 111.034 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -73.78 -7.34 51.76 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 28.7 t -159.92 148.37 13.55 Favored Pre-proline 0 C--O 1.232 0.144 0 C-N-CA 122.924 0.489 . . . . 0.0 110.547 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.55 -16.01 46.19 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.26 2.64 . . . . 0.0 110.557 174.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -85.37 150.55 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.44 156.3 46.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.65 1.18 . . . . 0.0 108.563 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 45.6 tpp -137.48 135.72 37.08 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.208 -0.308 . . . . 0.0 111.082 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.17 152.0 34.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -176.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -138.78 177.9 7.55 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 9.89 82.2 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.896 -0.391 . . . . 0.0 112.255 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 44.4 mt -78.27 28.03 0.19 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.473 0.709 . . . . 0.0 111.851 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -64.89 -27.55 68.93 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -175.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . 0.434 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.5 pm0 -79.16 150.91 31.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.006 0.431 . . . . 0.0 111.208 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.7 m -70.72 -5.83 32.77 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.02 -15.32 61.52 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 118.093 0.406 . . . . 0.0 111.921 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 71.3 mmm -95.13 147.08 23.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.196 0.453 . . . . 0.0 111.382 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -158.73 163.52 36.72 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.357 1.063 . . . . 0.0 108.508 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 86.8 m -54.28 -44.62 72.04 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.061 0.391 . . . . 0.0 110.857 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -68.01 -37.28 81.24 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -74.08 -48.39 30.07 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.09 -39.62 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.456 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 6.9 t80 -75.91 -31.91 59.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -71.05 -38.45 72.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.159 0.436 . . . . 0.0 110.198 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -61.82 -48.32 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 120.102 -0.639 . . . . 0.0 112.608 -176.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.523 2.5 p90 -76.6 -12.07 59.96 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 168.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.3 t -66.86 -24.79 66.18 Favored 'General case' 0 C--N 1.338 0.071 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.52 -37.16 25.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.242 0.617 . . . . 0.0 110.926 173.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -79.51 -14.86 58.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -176.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.16 -174.6 45.99 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 118.939 0.791 . . . . 0.0 112.946 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -73.54 124.88 26.73 Favored 'General case' 0 C--O 1.231 0.109 0 O-C-N 122.644 -0.327 . . . . 0.0 111.754 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.456 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.4 m -114.09 165.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.096 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 178.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -126.42 -59.51 1.3 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -146.58 166.18 27.27 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 118.852 0.751 . . . . 0.0 112.98 -173.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.28 148.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 124.472 1.109 . . . . 0.0 109.332 175.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -157.3 126.19 5.81 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.116 0.566 . . . . 0.0 111.042 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.92 153.87 38.41 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 36.4 mmt -86.62 117.03 25.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.308 0.643 . . . . 0.0 110.317 175.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -79.21 -15.77 57.55 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.425 -0.172 . . . . 0.0 111.4 171.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 32.5 t -90.15 -5.88 55.98 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -124.34 154.81 69.1 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 123.351 0.66 . . . . 0.0 109.836 -176.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.26 -17.06 40.03 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.412 2.741 . . . . 0.0 111.86 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.08 94.75 0.09 OUTLIER Glycine 0 C--N 1.336 0.536 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.41 163.01 35.84 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.537 0.735 . . . . 0.0 109.462 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.39 143.04 13.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 84.7 mtp -82.59 151.68 26.27 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.8 t -146.53 153.79 12.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -135.22 133.42 39.0 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.102 -0.374 . . . . 0.0 110.002 177.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 60.4 mtp -150.59 169.35 21.77 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.197 0.999 . . . . 0.0 109.461 -171.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.9 123.04 18.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 171.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.2 p30 -72.29 -33.55 67.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 -166.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.37 -89.62 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.33 -25.47 60.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.72 -32.68 16.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 118.735 -1.186 . . . . 0.0 112.208 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.68 -24.31 6.09 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 C-N-CA 118.04 -1.464 . . . . 0.0 109.031 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -69.34 -47.78 63.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.785 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -63.7 -40.25 96.31 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.06 -36.72 85.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.464 0.574 . . . . 0.0 110.589 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.8 mt -81.73 -10.16 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 123.066 0.547 . . . . 0.0 111.706 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 52.8 m -102.26 -16.56 16.27 Favored 'General case' 0 N--CA 1.461 0.082 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -135.42 -19.74 1.65 Allowed 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -170.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 8.9 tp -134.57 -15.34 2.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -170.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.565 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 17.8 p-10 -71.38 101.0 2.28 Favored 'General case' 0 C--O 1.204 -1.31 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -169.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.539 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 10.7 m-80 78.2 21.98 0.82 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 123.988 3.085 . . . . 0.0 113.889 -161.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -76.05 159.76 30.48 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.331 -0.855 . . . . 0.0 110.713 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -78.12 138.78 38.9 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 174.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.8 ttt -159.23 135.81 9.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.793 0.437 . . . . 0.0 109.919 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.329 51.9 m-85 58.07 21.56 8.01 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.79 7.24 88.37 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -124.18 -167.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.365 1.466 . . . . 0.0 108.459 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -138.4 151.19 47.25 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.546 0.338 . . . . 0.0 110.534 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -130.42 87.66 2.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.539 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.2 m120 -56.26 129.47 40.42 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 115.541 -2.171 . . . . 0.0 111.594 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.565 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.447 1.9 t -125.88 149.45 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 113.531 -3.268 . . . . 0.0 116.353 168.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 42.0 t -159.54 165.97 31.81 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.778 1.231 . . . . 0.0 108.166 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -71.38 148.63 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 22.2 t -85.34 161.98 19.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.017 0.527 . . . . 0.0 110.851 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -106.74 -0.23 23.7 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 117.515 0.143 . . . . 0.0 110.914 177.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -82.01 151.55 67.15 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.53 0.732 . . . . 0.0 110.317 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -77.43 -35.88 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.257 2.638 . . . . 0.0 112.208 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.76 158.84 9.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.352 0.661 . . . . 0.0 110.583 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.4 mt -79.96 146.71 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 81.9 mtp -119.25 130.14 25.01 Favored Pre-proline 0 N--CA 1.454 -0.253 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.87 163.81 34.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.632 2.888 . . . . 0.0 110.122 176.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.03 -125.04 1.71 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -72.43 166.62 22.21 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.948 0.499 . . . . 0.0 111.239 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 34.3 t -157.81 165.73 34.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.615 0.766 . . . . 0.0 109.773 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -125.62 -1.61 7.39 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.79 -178.8 51.83 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.005 0.336 . . . . 0.0 112.488 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 90.5 mt -143.77 160.53 40.56 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.964 0.906 . . . . 0.0 109.769 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.51 -12.0 61.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.752 0.421 . . . . 0.0 111.647 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -120.48 20.74 11.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.175 0.59 . . . . 0.0 110.29 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -169.77 -153.37 8.52 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.2 m -132.92 -15.44 2.63 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.2 t -127.06 146.25 50.43 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.753 0.421 . . . . 0.0 110.117 176.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.7 p -93.82 10.5 32.88 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.415 0.686 . . . . 0.0 110.874 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -135.61 147.92 48.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -156.77 154.24 29.63 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-O 120.704 0.288 . . . . 0.0 110.375 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 0.4 OUTLIER -132.63 140.19 48.09 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.888 0.875 . . . . 0.0 113.148 179.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.291 15.8 m-85 -111.03 8.61 21.96 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 117.638 2.458 . . . . 0.0 117.638 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.2 t -71.67 -28.68 63.9 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -92.5 -18.66 22.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.919 0.888 . . . . 0.0 111.289 178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 75.0 m -76.59 -17.78 59.01 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.93 2.24 0.97 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.66 1.184 . . . . 0.0 114.103 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -62.74 -15.4 53.05 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.462 -0.774 . . . . 0.0 112.862 -178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.21 124.62 17.58 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.81 0.444 . . . . 0.0 110.976 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -72.81 -33.52 66.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.62 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.328 57.9 m-85 -98.02 17.27 18.75 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.2 t -61.76 -22.11 65.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.48 152.05 74.1 Favored Pre-proline 0 C--N 1.339 0.134 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.68 -31.73 69.25 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.249 2.632 . . . . 0.0 112.43 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -78.86 -21.74 47.08 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 117.689 0.222 . . . . 0.0 111.091 -178.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -80.66 -41.95 22.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.84 -20.02 64.66 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.633 0.373 . . . . 0.0 111.912 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.42 -20.41 47.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.04 2.59 8.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -61.99 155.76 22.94 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.315 0.507 . . . . 0.0 111.934 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 18.4 mtt180 -141.92 131.57 24.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.5 mm -139.65 145.11 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 123.723 0.809 . . . . 0.0 109.001 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -158.29 159.22 35.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.152 0.581 . . . . 0.0 109.455 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -60.51 158.61 29.06 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -61.35 146.1 97.6 Favored 'Trans proline' 0 N--CA 1.451 -1.026 0 C-N-CA 122.292 1.995 . . . . 0.0 109.946 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -153.7 171.47 18.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -175.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -83.65 -7.88 59.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 1.9 t -85.46 141.92 13.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 174.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 11.7 tp -139.9 150.94 45.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.515 0.326 . . . . 0.0 110.209 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -125.01 150.06 47.1 Favored 'General case' 0 C--N 1.334 -0.106 0 C-N-CA 124.05 0.94 . . . . 0.0 108.848 -177.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -139.63 159.26 42.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.294 0.568 . . . . 0.0 111.952 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -150.42 166.34 30.39 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.3 m120 54.42 57.16 6.06 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.341 0.257 . . . . 0.0 111.215 -175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -129.34 150.61 76.02 Favored Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 122.455 0.302 . . . . 0.0 110.929 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . 0.428 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 52.2 Cg_exo -55.96 156.51 19.5 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.703 2.936 . . . . 0.0 113.014 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.27 -16.68 64.05 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.461 0.704 . . . . 0.0 111.058 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -122.67 24.3 9.2 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.89 0.876 . . . . 0.0 110.831 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.0 p -63.3 -13.16 12.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.575 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -55.37 -177.6 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 117.977 -1.011 . . . . 0.0 113.556 -165.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.575 ' H ' HG23 ' A' ' 510' ' ' THR . 22.8 pt-20 -21.29 -41.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -170.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.3 mt-10 -56.1 -48.75 75.54 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 117.413 -1.28 . . . . 0.0 114.413 172.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -87.07 -26.07 23.87 Favored 'General case' 0 C--N 1.35 0.61 0 CA-C-N 122.474 2.397 . . . . 0.0 106.886 -173.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -66.98 -38.22 85.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -73.39 -40.27 64.46 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -76.07 -22.82 55.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.483 -177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 55.8 mt -77.08 -45.31 30.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-N 118.417 0.553 . . . . 0.0 110.924 178.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 28.4 p -71.81 -27.58 63.02 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.599 -178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -71.7 -36.77 70.65 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.792 0.33 . . . . 0.0 111.499 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.61 -28.77 66.22 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.388 0.275 . . . . 0.0 111.307 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 91.4 mt -94.85 -5.63 44.59 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.658 0.383 . . . . 0.0 111.569 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.86 1.61 62.84 Favored Glycine 0 CA--C 1.531 1.052 0 CA-C-O 119.584 -0.564 . . . . 0.0 113.119 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.3 m -76.91 163.65 3.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 118.18 0.99 . . . . 0.0 112.941 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.43 144.97 53.22 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -83.43 144.18 45.86 Favored Pre-proline 0 N--CA 1.455 -0.215 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.154 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -70.17 151.61 66.82 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.303 2.668 . . . . 0.0 110.839 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -95.51 -17.61 21.31 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 176.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 27.8 t -152.42 159.79 43.35 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-O 120.597 0.237 . . . . 0.0 111.031 175.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 7.5 p -155.27 150.1 11.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 C-N-CA 123.184 0.593 . . . . 0.0 110.267 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -150.53 144.06 25.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.465 1.106 . . . . 0.0 108.8 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.21 151.94 31.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -156.61 -173.27 4.4 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -178.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 90.8 p -140.42 -177.47 5.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.011 0.924 . . . . 0.0 110.376 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.26 -8.97 62.91 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 123.839 0.733 . . . . 0.0 112.223 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.32 -28.26 21.15 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.95 0.875 . . . . 0.0 111.437 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.5 t -166.4 159.71 14.92 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.26 0.624 . . . . 0.0 110.057 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.08 -7.83 31.79 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.631 0.372 . . . . 0.0 110.296 175.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -79.77 -30.52 40.73 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.8 p -164.91 168.7 17.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.196 0.522 . . . . 0.0 112.057 -173.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 40.6 t -82.82 166.93 18.57 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.756 0.823 . . . . 0.0 110.325 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 62.7 m -142.65 159.23 42.64 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.349 1.06 . . . . 0.0 108.405 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.47 -174.16 46.66 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 119.834 -1.175 . . . . 0.0 113.415 -179.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.24 160.27 22.5 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.691 0.796 . . . . 0.0 110.699 -177.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 87.6 mt -142.03 162.47 35.41 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.572 1.549 . . . . 0.0 108.198 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -152.32 148.69 27.82 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.26 -0.275 . . . . 0.0 110.907 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 10.5 m-90 -126.41 175.27 7.99 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 125.228 1.411 . . . . 0.0 112.624 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -75.59 -9.78 58.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 42.0 t -161.38 158.09 26.31 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 122.852 0.461 . . . . 0.0 110.635 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.0 -21.01 63.26 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.361 0.264 . . . . 0.0 111.13 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.3 p -80.69 -24.83 38.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 117.929 0.331 . . . . 0.0 110.65 177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -76.26 -34.16 59.16 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.16 -26.29 59.01 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 175.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.1 tp -77.41 -35.75 53.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.726 0.41 . . . . 0.0 110.882 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.97 -37.58 75.82 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.9 m -72.77 -30.21 63.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -63.48 -33.83 76.44 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.0 -56.58 17.67 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 14.3 m-85 -82.38 -16.89 47.48 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -175.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.74 -13.95 14.91 Favored 'General case' 0 C--N 1.338 0.08 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -73.68 142.3 46.41 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.894 1.225 . . . . 0.0 108.995 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 60.67 10.55 2.67 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.49 1.116 . . . . 0.0 112.967 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 33.6 t80 -73.48 141.47 46.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -73.02 142.48 47.69 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' MET . . . . . 0.428 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 78.4 mtm -83.58 152.33 24.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.316 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 62.1 pttt . . . . . 0 CA--C 1.53 0.191 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.335 -176.823 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 CA--C 1.529 0.164 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.76 154.51 67.64 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 123.126 2.551 . . . . 0.0 111.704 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -130.01 142.45 50.63 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 102.887 -3.005 . . . . 0.0 102.887 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 145.87 50.85 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 116.064 1.876 . . . . 0.0 116.064 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.4 tt -100.96 153.95 19.09 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.891 1.276 . . . . 0.0 108.378 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.536 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -142.8 155.42 44.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 120.982 0.42 . . . . 0.0 111.042 179.82 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.44 162.91 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.57 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.0 p -159.24 164.86 34.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.473 0.709 . . . . 0.0 111.442 -172.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -56.53 123.51 15.06 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.1 t -77.43 145.65 37.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.268 0.8 OUTLIER -110.86 9.09 22.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 169.802 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.47 164.23 19.25 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.957 0.903 . . . . 0.0 111.112 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -90.75 1.31 56.99 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.939 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -177.41 176.58 1.29 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.531 1.132 . . . . 0.0 109.856 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -138.96 20.05 2.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.967 0.507 . . . . 0.0 111.226 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.248 -179.406 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.453 -0.865 0 N-CA-C 110.847 -0.482 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -149.3 156.87 42.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.988 0.423 . . . . 0.0 110.74 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.58 162.39 29.27 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.901 0.48 . . . . 0.0 111.164 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -72.64 -8.0 53.13 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -178.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -159.64 148.53 14.02 Favored Pre-proline 0 N--CA 1.455 -0.221 0 C-N-CA 122.635 0.374 . . . . 0.0 110.948 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.57 -19.29 44.17 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.697 2.931 . . . . 0.0 111.56 172.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.79 148.56 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.0 tt -132.67 152.83 51.58 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.981 1.313 . . . . 0.0 108.372 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -135.96 132.44 36.39 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -175.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.38 153.6 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -143.85 166.14 25.75 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 104.778 -2.304 . . . . 0.0 104.778 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 91.62 11.3 60.82 Favored Glycine 0 CA--C 1.529 0.914 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 54.3 mt -81.19 35.11 0.38 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.934 0.894 . . . . 0.0 110.91 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.292 8.5 p30 -81.65 25.21 0.54 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -171.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -134.45 157.79 45.56 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 123.042 0.537 . . . . 0.0 110.684 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -69.08 -11.53 60.87 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.65 0.78 . . . . 0.0 112.962 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -80.31 -9.25 59.73 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.5 0.32 . . . . 0.0 111.563 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 61.6 mmm -96.23 144.26 26.59 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 118.021 0.373 . . . . 0.0 110.273 -177.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -159.51 153.22 22.86 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.5 p -58.54 -30.23 66.94 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -72.05 -41.84 66.99 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 177.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 84.6 mtt-85 -75.99 -44.97 37.06 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.731 0.301 . . . . 0.0 111.245 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.29 -41.73 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -174.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -73.63 -41.14 63.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . 0.497 ' HA ' ' SG ' ' A' ' 401' ' ' CYS . 3.9 p30 -66.56 -31.13 71.64 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.696 -0.802 . . . . 0.0 109.269 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.84 -60.77 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 107.186 -1.412 . . . . 0.0 107.186 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.481 0.6 OUTLIER -76.61 -20.48 56.7 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 118.936 2.939 . . . . 0.0 118.936 177.765 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . 0.497 ' SG ' ' HA ' ' A' ' 398' ' ' ASN . 2.8 p -81.64 -19.26 42.13 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.07 0.85 . . . . 0.0 111.139 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.5 pp -61.29 -15.2 32.88 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.978 0.808 . . . . 0.0 111.107 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -76.46 -8.12 56.51 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -171.14 -147.57 5.69 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 -175.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -88.22 159.88 17.95 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.712 0.405 . . . . 0.0 110.965 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.7 m -114.17 154.07 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -144.77 -74.66 0.24 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -149.05 167.58 25.48 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 -172.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 4.3 p -154.81 147.28 13.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 124.794 1.237 . . . . 0.0 108.551 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -157.04 133.37 9.81 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -81.39 168.32 18.49 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.942 1.83 . . . . 0.0 115.942 177.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 50.5 mtt -130.89 128.18 40.03 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-O 120.9 0.381 . . . . 0.0 111.6 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -5.94 55.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.832 0.853 . . . . 0.0 112.341 175.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.5 p -83.32 -7.25 59.61 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.331 0.652 . . . . 0.0 112.451 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.08 157.55 77.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 C-N-CA 123.86 0.864 . . . . 0.0 109.422 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.93 -14.25 43.0 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.26 2.64 . . . . 0.0 111.235 177.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.74 98.67 0.11 Allowed Glycine 0 C--N 1.338 0.645 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 175.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.84 158.17 36.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.36 0.664 . . . . 0.0 109.492 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.39 150.85 23.9 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.275 0.559 . . . . 0.0 112.231 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 34.6 ttm -96.57 151.8 19.25 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.559 1.144 . . . . 0.0 108.313 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 37.9 t -144.85 154.28 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -142.42 135.8 28.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 71.7 mtm -160.45 177.58 10.42 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.355 1.462 . . . . 0.0 108.987 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.61 125.5 24.47 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 171.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -72.3 -33.57 67.5 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.34 -84.43 0.04 OUTLIER Glycine 0 C--N 1.333 0.413 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -73.52 -29.32 62.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.25 -35.14 18.67 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.431 -174.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.43 -24.96 6.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.311 0 C-N-CA 118.916 -1.114 . . . . 0.0 109.828 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -70.33 -50.37 39.85 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.46 174.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -64.32 -36.05 82.86 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.623 -0.673 . . . . 0.0 112.032 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.63 -34.57 78.53 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.005 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -80.62 -8.04 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.528 0.731 . . . . 0.0 111.141 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 7.1 m -100.37 -18.87 16.56 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 176.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -131.89 -21.34 2.44 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -170.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 86.7 mt -134.43 -14.37 2.25 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.548 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.0 p-10 -71.65 100.86 2.39 Favored 'General case' 0 C--O 1.205 -1.285 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -170.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.525 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 22.7 m-80 77.07 21.94 1.06 Allowed 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 124.11 3.141 . . . . 0.0 112.526 -159.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -87.65 154.95 20.19 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 168.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -78.33 140.58 38.78 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -154.87 134.63 12.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.198 0.599 . . . . 0.0 110.272 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.388 48.4 m-85 59.43 19.09 7.44 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.93 10.73 62.46 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 120.017 -0.324 . . . . 0.0 112.446 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -146.14 150.18 35.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 117.411 0.606 . . . . 0.0 110.405 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -84.94 149.69 25.46 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.253 -0.279 . . . . 0.0 110.928 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -131.37 92.43 3.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.983 0.513 . . . . 0.0 109.636 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.525 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 21.5 t-20 -58.51 130.7 48.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 115.877 -2.011 . . . . 0.0 112.048 -171.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.548 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.451 2.2 t -124.88 149.7 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 113.46 -3.296 . . . . 0.0 116.416 168.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 34.4 t -161.39 172.91 15.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.162 1.385 . . . . 0.0 108.302 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.92 145.7 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 30.2 t -85.55 157.93 20.27 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 122.744 0.418 . . . . 0.0 110.877 177.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -96.57 -4.32 41.46 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.435 -0.166 . . . . 0.0 110.777 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -78.95 152.15 76.84 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.736 0.814 . . . . 0.0 111.111 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.13 -34.81 1.04 Allowed 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.56 2.84 . . . . 0.0 112.068 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.28 159.76 10.97 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 122.961 0.504 . . . . 0.0 111.107 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.3 mt -78.27 136.7 23.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 61.4 mmm -103.59 125.12 35.7 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 122.311 0.244 . . . . 0.0 110.975 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -78.16 173.31 14.1 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.904 3.07 . . . . 0.0 110.187 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 128.52 -108.57 0.92 Allowed Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -72.42 153.17 41.56 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.349 0.659 . . . . 0.0 110.679 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.2 p -159.04 175.22 13.8 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.28 0.632 . . . . 0.0 110.095 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -143.33 163.82 31.97 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.91 135.11 14.5 Favored Glycine 0 CA--C 1.525 0.659 0 O-C-N 122.099 -0.376 . . . . 0.0 112.66 -174.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.34 165.58 14.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.253 0.621 . . . . 0.0 109.516 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -72.7 -19.54 61.38 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.162 -0.336 . . . . 0.0 111.732 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -120.52 24.9 10.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.088 0.555 . . . . 0.0 109.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.2 -159.62 13.08 Favored Glycine 0 C--N 1.337 0.631 0 O-C-N 121.715 -0.616 . . . . 0.0 111.817 -177.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.5 t -133.09 -17.86 2.36 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.8 t -127.1 143.53 51.25 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.73 0.412 . . . . 0.0 110.04 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.6 p -86.74 1.59 51.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 123.168 0.587 . . . . 0.0 111.809 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.258 19.6 t80 -128.57 145.72 51.05 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 115.634 1.716 . . . . 0.0 115.634 -178.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -153.61 149.5 27.66 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.857 0.463 . . . . 0.0 109.952 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.251 0.1 OUTLIER -130.2 140.87 50.69 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 179.006 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.267 65.7 m-85 -111.75 -2.43 15.3 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -178.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 44.7 t -73.59 -26.31 60.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.13 14.99 2.06 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.699 0.8 . . . . 0.0 111.028 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 48.3 t -137.24 169.23 18.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.604 0.762 . . . . 0.0 110.56 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.04 6.49 31.2 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.111 0.565 . . . . 0.0 111.569 -176.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -62.06 -18.5 60.85 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.08 117.92 5.25 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.098 0.559 . . . . 0.0 111.657 -178.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -81.17 -33.59 32.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.277 62.3 m-85 -97.94 3.5 49.6 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -176.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 57.8 m -87.76 7.0 32.32 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -172.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' THR . . . . . 0.442 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.77 144.46 53.0 Favored Pre-proline 0 C--O 1.231 0.1 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 177.278 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.0 Cg_exo -64.66 -29.58 60.36 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.024 2.482 . . . . 0.0 112.372 -178.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -81.33 -26.4 35.66 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.667 -0.206 . . . . 0.0 111.18 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -82.25 -42.35 19.01 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.29 0.496 . . . . 0.0 110.906 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.35 -16.45 54.52 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.97 -21.52 33.98 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -124.04 4.13 8.64 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -64.02 155.44 31.14 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.779 0.718 . . . . 0.0 111.493 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -144.06 126.21 15.56 Favored 'General case' 0 N--CA 1.458 -0.062 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -174.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.8 mm -148.63 123.25 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 C-N-CA 124.351 1.06 . . . . 0.0 108.324 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -162.1 97.68 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.901 0.318 . . . . 0.0 110.781 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 15.1 p80 54.32 155.13 0.05 OUTLIER Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 127.501 2.32 . . . . 0.0 114.596 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.7 76.2 3.75 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.536 2.824 . . . . 0.0 109.837 176.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.1 t -65.01 161.0 19.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.129 0.572 . . . . 0.0 110.856 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -83.84 -7.41 59.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 5.0 t -85.32 148.7 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.952 0.901 . . . . 0.0 110.8 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 10.2 tp -136.59 151.57 49.5 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -123.25 146.21 48.04 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -140.13 155.64 46.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.459 0.647 . . . . 0.0 109.34 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -148.44 163.77 36.15 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 104.423 -2.436 . . . . 0.0 104.423 -174.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 60.94 57.23 2.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.733 0.813 . . . . 0.0 112.044 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -137.39 137.09 21.42 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.945 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -49.83 159.91 1.42 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.863 3.042 . . . . 0.0 113.038 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . 0.524 HD11 ' H ' ' A' ' 507' ' ' LEU . 2.9 mp -68.52 -16.5 63.9 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -173.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.6 19.93 11.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 15.2 m -71.55 5.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.581 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.8 OUTLIER -54.88 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 117.497 -1.24 . . . . 0.0 113.223 -167.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.581 ' H ' HG21 ' A' ' 510' ' ' THR . 23.2 pt-20 -23.64 -37.29 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -171.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 92.9 mt-10 -56.85 -49.74 74.56 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 117.416 -1.278 . . . . 0.0 114.009 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -85.1 -25.75 27.34 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 122.286 2.312 . . . . 0.0 106.69 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -65.87 -38.37 88.61 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -74.44 -42.12 59.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.47 -24.64 59.07 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.094 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -74.48 -38.68 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.27 0.486 . . . . 0.0 109.983 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 93.5 m -67.41 -36.61 81.61 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 122.023 -0.423 . . . . 0.0 110.863 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -69.62 -29.18 66.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -76.58 -27.36 55.81 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 122.15 0.18 . . . . 0.0 111.186 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 80.1 mt -96.07 -6.06 39.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.893 0.477 . . . . 0.0 111.62 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.47 -8.57 25.81 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-O 119.472 -0.627 . . . . 0.0 113.195 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 m -76.92 155.37 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 118.384 1.092 . . . . 0.0 112.022 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -68.54 151.12 47.22 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.297 0.57 . . . . 0.0 112.024 -173.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -71.94 155.04 92.4 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.984 0.913 . . . . 0.0 111.286 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.24 155.1 65.12 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.387 2.725 . . . . 0.0 110.949 175.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -88.38 -20.57 25.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 14.1 t -153.91 164.03 39.08 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 110.994 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 3.1 p -160.34 146.81 5.93 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 C-N-CA 123.119 0.568 . . . . 0.0 109.469 -176.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -143.23 137.8 29.2 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.166 0.986 . . . . 0.0 108.929 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.2 146.99 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.343 0.657 . . . . 0.0 110.834 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -155.38 174.84 14.66 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 -173.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 80.8 p -62.93 134.78 56.73 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.503 0.668 . . . . 0.0 110.347 177.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -70.84 163.96 53.49 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.502 -175.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -81.05 12.13 3.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.411 1.084 . . . . 0.0 111.5 177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 30.2 t -155.38 -172.73 4.27 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.335 1.054 . . . . 0.0 108.968 -177.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.85 -7.88 32.36 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -89.55 110.4 21.25 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.428 0.691 . . . . 0.0 110.593 172.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 68.2 m 53.6 -163.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.882 0.873 . . . . 0.0 112.954 174.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 20.7 m -140.8 178.49 7.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.523 1.129 . . . . 0.0 110.896 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.8 m -137.6 168.56 19.42 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . -174.88 179.32 46.26 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.669 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -121.75 158.4 28.87 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.729 0.812 . . . . 0.0 109.864 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.1 mt -141.26 166.7 24.05 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 124.728 1.211 . . . . 0.0 109.385 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -153.85 150.74 28.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.193 -0.317 . . . . 0.0 110.708 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 20.8 m-90 -130.54 165.52 22.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.792 1.237 . . . . 0.0 111.638 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -68.17 -7.04 26.63 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.2 t -160.13 160.92 33.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.559 0.344 . . . . 0.0 110.794 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -67.46 -27.96 67.47 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 177.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.0 m -76.95 -26.58 54.18 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.462 0.305 . . . . 0.0 110.727 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.19 -36.89 66.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 177.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.95 -24.55 52.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 175.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.9 tp -78.79 -36.81 42.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.895 0.478 . . . . 0.0 111.481 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -75.22 -38.73 60.55 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.85 -24.41 64.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.33 -33.7 73.52 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.42 -27.03 73.26 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.34 9.1 m-85 -100.31 -6.11 26.39 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 118.961 2.949 . . . . 0.0 118.961 177.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.6 mt -123.9 -9.42 7.76 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -73.36 139.69 46.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.838 1.199 . . . . 0.0 109.356 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 56.19 17.44 2.76 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.311 1.045 . . . . 0.0 112.719 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -70.32 138.94 51.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -74.42 129.55 37.98 Favored 'General case' 0 N--CA 1.455 -0.185 0 O-C-N 122.195 -0.315 . . . . 0.0 111.083 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.9 mtm -83.53 152.45 24.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.569 0.223 . . . . 0.0 111.122 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 64.4 pttt . . . . . 0 CA--C 1.532 0.269 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.933 178.524 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.262 4.7 p90 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.4 157.06 57.51 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.588 2.859 . . . . 0.0 112.264 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.87 142.46 50.66 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 102.807 -3.035 . . . . 0.0 102.807 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -73.35 137.56 44.81 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -86.3 138.25 31.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.928 1.291 . . . . 0.0 108.145 175.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.535 ' HZ1' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -127.99 146.57 50.62 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.597 0.635 . . . . 0.0 110.458 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.3 161.29 39.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.091 0.472 . . . . 0.0 111.281 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.53 172.14 14.85 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.039 0.935 . . . . 0.0 110.166 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -54.99 121.96 9.85 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 32.1 t -78.65 152.33 31.75 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.4 t -118.61 10.64 12.59 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 170.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.33 162.49 14.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.47 0.652 . . . . 0.0 111.867 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -82.99 8.88 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.894 0.878 . . . . 0.0 112.741 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -160.2 178.11 9.98 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.475 0.579 . . . . 0.0 111.31 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.51 12.43 1.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.085 0.954 . . . . 0.0 110.112 169.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.39 -1.29 . . . . 0.0 110.401 -176.391 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 N--CA 1.454 -0.805 0 N-CA-C 110.84 -0.485 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -147.3 153.37 39.65 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 122.836 0.455 . . . . 0.0 110.719 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -76.28 159.47 30.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.767 0.427 . . . . 0.0 110.714 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -82.44 1.48 37.3 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.4 t -157.77 145.38 13.72 Favored Pre-proline 0 N--CA 1.456 -0.174 0 C-N-CA 122.83 0.452 . . . . 0.0 110.69 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.54 -15.05 41.04 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.661 2.907 . . . . 0.0 110.676 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 t -88.93 149.0 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.57 155.88 47.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.253 1.021 . . . . 0.0 108.429 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.1 tpt -139.37 133.76 31.55 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 122.01 -0.431 . . . . 0.0 110.808 -174.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.16 153.53 37.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -139.48 166.45 24.53 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 90.68 9.48 64.37 Favored Glycine 0 CA--C 1.529 0.954 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.659 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.8 mt -78.1 25.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.77 0.785 . . . . 0.0 112.483 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -67.49 -15.57 63.74 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -72.21 155.36 40.31 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.644 -0.66 . . . . 0.0 111.958 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.8 p -68.72 -9.17 48.98 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 123.591 0.756 . . . . 0.0 111.328 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -95.63 5.08 52.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.723 0.809 . . . . 0.0 111.254 -173.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 59.1 mmm -106.33 138.14 43.04 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -177.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -160.18 157.98 29.3 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.443 0.697 . . . . 0.0 109.863 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 92.9 m -52.27 -41.76 63.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.58 0.352 . . . . 0.0 111.668 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -72.17 -36.51 69.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -76.02 -47.25 25.58 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -174.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 18.6 t -69.75 -40.78 79.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.404 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 3.6 t80 -78.27 -31.34 49.01 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.009 -170.045 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -74.66 -31.05 61.81 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 119.897 1.226 . . . . 0.0 109.84 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.78 -56.48 17.58 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.556 2.3 p90 -76.55 -3.79 39.36 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 174.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 35.7 t -75.05 -35.11 61.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 122.07 -0.394 . . . . 0.0 111.357 177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.4 -15.46 36.85 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -80.69 -7.18 59.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.91 2.189 . . . . 0.0 116.91 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -179.54 -130.64 1.49 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 118.289 0.495 . . . . 0.0 111.963 -175.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -136.49 124.15 22.38 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.404 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.4 m -114.02 165.46 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -174.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -118.04 -61.49 1.67 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -154.38 166.16 34.09 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.5 p -145.57 152.03 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 C-N-CA 124.604 1.162 . . . . 0.0 109.828 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -155.62 131.84 10.16 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.254 3.3 m-85 -82.73 164.03 20.92 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 116.871 2.175 . . . . 0.0 116.871 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.8 mmt -106.7 120.4 41.89 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.336 0.654 . . . . 0.0 112.44 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -79.1 -20.52 48.5 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.625 0.77 . . . . 0.0 111.31 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 42.3 t -81.45 -19.51 42.25 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.061 0.545 . . . . 0.0 112.355 -175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -115.64 157.87 43.28 Favored Pre-proline 0 N--CA 1.456 -0.156 0 C-N-CA 123.371 0.669 . . . . 0.0 109.759 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 -18.55 55.9 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.712 2.275 . . . . 0.0 110.791 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.64 103.82 0.17 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 176.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.36 162.37 33.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.802 0.841 . . . . 0.0 109.194 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.13 147.0 16.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 112.067 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 80.2 mtp -90.02 152.82 21.0 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.308 170.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.63 152.56 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 123.603 0.761 . . . . 0.0 110.228 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -136.31 130.35 32.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.595 0.634 . . . . 0.0 109.84 175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.0 mtp -151.0 171.22 17.63 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.449 0.7 . . . . 0.0 109.14 -169.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.52 123.27 19.2 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -72.61 -33.43 66.67 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -167.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.9 -88.66 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -72.27 -26.47 62.0 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -175.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.15 -34.23 15.94 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.265 -174.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.18 -24.44 6.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 118.096 -1.442 . . . . 0.0 109.155 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -67.6 -50.41 58.38 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.527 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -65.18 -38.88 91.9 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.53 -37.51 85.17 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.785 0.72 . . . . 0.0 109.987 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 57.8 mt -77.45 -9.08 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.453 0.701 . . . . 0.0 111.713 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 76.7 m -102.85 -15.52 16.19 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -133.11 -24.81 1.84 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 -169.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.5 mp -133.98 -12.33 2.55 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.385 1.448 . . . . 0.0 113.329 -172.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.558 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -70.97 101.15 2.12 Favored 'General case' 0 C--O 1.206 -1.208 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -169.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.551 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 13.1 m-80 77.1 22.07 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 124.518 3.326 . . . . 0.0 113.669 -161.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.12 162.94 20.1 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 167.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -81.21 138.61 35.8 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.3 ttt -153.74 137.85 16.45 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.46 0.704 . . . . 0.0 109.71 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.5 m-85 57.46 21.53 7.07 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.95 7.33 66.15 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.44 -0.644 . . . . 0.0 113.089 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -149.91 154.27 38.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.03 0.915 . . . . 0.0 110.579 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -73.96 146.21 44.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.996 0.518 . . . . 0.0 111.818 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -125.12 84.45 2.28 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.243 1.017 . . . . 0.0 108.814 175.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.551 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.5 m120 -55.16 128.39 33.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.756 -170.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.558 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.0 t -126.99 149.0 31.76 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 C-N-CA 113.486 -3.286 . . . . 0.0 115.848 168.545 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.6 t -160.28 170.7 20.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.554 1.542 . . . . 0.0 107.763 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.1 148.87 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 20.6 t -83.36 166.47 18.41 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 122.983 0.513 . . . . 0.0 110.634 177.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.86 11.69 10.41 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -85.15 152.84 59.14 Favored Pre-proline 0 CA--C 1.532 0.259 0 C-N-CA 123.46 0.704 . . . . 0.0 110.22 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -65.49 -46.57 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.888 2.392 . . . . 0.0 112.468 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -170.02 160.29 8.13 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.902 0.881 . . . . 0.0 109.751 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.8 mt -77.91 143.08 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.2 mtp -114.16 134.12 22.26 Favored Pre-proline 0 N--CA 1.454 -0.236 0 O-C-N 122.407 -0.183 . . . . 0.0 111.033 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.38 161.47 40.17 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.497 2.798 . . . . 0.0 109.282 174.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 159.76 -132.15 2.91 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -72.47 161.79 30.34 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.892 0.477 . . . . 0.0 110.021 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.0 p -149.3 168.78 22.4 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.341 0.656 . . . . 0.0 110.03 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -129.34 -1.25 5.05 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.49 -178.95 46.98 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 -178.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.79 159.43 42.88 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.162 0.985 . . . . 0.0 109.453 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -76.7 -9.28 58.56 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -120.62 24.93 10.05 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.611 0.764 . . . . 0.0 110.249 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.89 -152.97 9.34 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.0 m -133.01 -12.67 2.85 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 178.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 19.4 p -127.04 150.86 49.25 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.274 0.63 . . . . 0.0 111.924 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.2 p -99.8 4.74 45.44 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.334 0.653 . . . . 0.0 110.884 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -141.6 148.24 38.91 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.374 1.47 . . . . 0.0 113.574 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -151.08 156.15 40.45 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 118.274 0.488 . . . . 0.0 111.291 -176.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -127.96 137.08 52.12 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -129.92 -1.78 4.69 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -68.22 -30.59 69.69 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.643 0.377 . . . . 0.0 111.749 -174.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -91.19 -2.72 57.45 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.683 0.393 . . . . 0.0 111.418 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 46.3 t -96.3 151.31 19.64 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.821 0.449 . . . . 0.0 111.927 -176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -90.97 5.3 49.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.874 0.47 . . . . 0.0 111.183 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.05 -22.3 65.64 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.678 0.391 . . . . 0.0 111.656 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -60.71 137.7 58.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.905 0.482 . . . . 0.0 109.917 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -72.12 -24.75 61.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.16 -175.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.269 51.8 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 88.6 p -61.19 -22.16 64.49 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -169.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.59 157.72 67.44 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.48 -23.8 75.11 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.876 2.384 . . . . 0.0 111.298 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -80.96 -31.78 34.7 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -76.97 -28.11 55.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -73.45 -21.38 60.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 122.652 0.381 . . . . 0.0 110.72 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.9 -12.97 58.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.879 0.472 . . . . 0.0 111.895 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -123.97 16.53 9.3 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.966 0.507 . . . . 0.0 110.676 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 149.17 48.58 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 111.41 -174.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -145.6 130.46 18.17 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 30.1 mm -140.53 137.54 36.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 122.777 0.431 . . . . 0.0 110.153 -175.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -152.26 167.42 28.66 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.44 1.096 . . . . 0.0 109.624 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -64.74 157.61 73.38 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.63 148.61 92.63 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.37 2.047 . . . . 0.0 109.584 178.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -152.46 174.72 13.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -83.82 -7.66 59.4 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -86.76 140.24 16.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 112.328 173.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 14.4 tp -137.56 142.72 41.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -112.32 150.93 30.33 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.783 0.833 . . . . 0.0 109.406 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -146.46 160.22 42.37 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.456 0.646 . . . . 0.0 109.646 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -151.63 167.55 27.77 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 32.8 m120 53.28 55.71 8.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.612 0.365 . . . . 0.0 111.427 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.22 152.85 52.92 Favored Pre-proline 0 CA--C 1.531 0.217 0 C-N-CA 122.323 0.249 . . . . 0.0 110.454 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.15 152.4 38.06 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.152 2.568 . . . . 0.0 112.157 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.78 -16.4 63.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.97 0.508 . . . . 0.0 112.203 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -122.06 24.62 9.45 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.615 0.766 . . . . 0.0 110.897 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.74 -13.23 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 -176.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.563 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.3 -178.37 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -166.484 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.563 ' H ' HG23 ' A' ' 510' ' ' THR . 23.0 pt-20 -20.23 -42.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.6 mt-10 -56.15 -49.24 74.52 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 172.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -87.17 -27.04 23.26 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 122.034 2.197 . . . . 0.0 106.732 -173.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -64.95 -39.92 94.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -70.53 -44.42 67.55 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -75.31 -26.56 58.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.085 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.3 mt -71.6 -37.38 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.044 0 CA-C-N 118.858 0.754 . . . . 0.0 110.203 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 94.5 m -67.3 -29.97 69.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.897 -0.502 . . . . 0.0 111.026 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -73.85 -28.98 61.86 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -78.36 -11.51 59.95 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.98 -4.88 12.52 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.173 0.589 . . . . 0.0 111.55 -179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.8 3.87 60.57 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 123.572 0.606 . . . . 0.0 112.82 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.94 157.13 5.46 Favored 'Isoleucine or valine' 0 C--N 1.339 0.129 0 CA-C-N 117.831 0.815 . . . . 0.0 112.813 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.53 144.5 55.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.575 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 55.3 ptt85 -80.81 149.43 67.32 Favored Pre-proline 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.63 148.3 65.57 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 123.058 2.505 . . . . 0.0 110.311 177.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.7 t -85.64 -21.01 28.62 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -146.84 154.64 41.57 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 122.978 0.511 . . . . 0.0 110.786 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 76.8 t -144.72 145.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 123.649 0.779 . . . . 0.0 109.913 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -152.85 143.63 22.85 Favored 'General case' 0 C--N 1.337 0.049 0 C-N-CA 123.002 0.521 . . . . 0.0 109.994 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -138.62 150.64 23.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.057 0 C-N-CA 123.43 0.692 . . . . 0.0 112.13 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -154.85 -178.72 7.42 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -178.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.8 t -134.06 -177.76 4.72 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.307 1.043 . . . . 0.0 109.77 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 99.76 9.82 48.44 Favored Glycine 0 CA--C 1.527 0.826 0 CA-C-O 119.746 -0.474 . . . . 0.0 111.97 -177.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -125.67 -26.07 3.58 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 117.659 0.729 . . . . 0.0 112.5 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.3 t -164.52 155.09 14.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.812 0.445 . . . . 0.0 110.587 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -103.43 -8.05 20.48 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.038 0.535 . . . . 0.0 110.532 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -78.47 -38.42 41.06 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 122.723 0.409 . . . . 0.0 112.055 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 58.4 m -156.06 167.7 29.57 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 111.399 -171.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -83.8 167.52 17.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.644 0.778 . . . . 0.0 110.825 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -151.52 160.21 43.79 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 124.322 1.049 . . . . 0.0 108.616 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.05 -168.46 41.6 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.833 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.02 160.27 22.32 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.507 0.723 . . . . 0.0 110.827 -179.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.4 mt -138.06 161.76 35.92 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.268 1.427 . . . . 0.0 107.921 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -151.64 147.41 26.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.244 -0.285 . . . . 0.0 110.873 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -125.03 173.54 8.62 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.722 1.209 . . . . 0.0 112.723 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -74.68 -7.55 53.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.8 t -158.98 158.26 32.89 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 122.484 0.314 . . . . 0.0 111.119 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -68.05 -27.91 66.93 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.501 0.32 . . . . 0.0 110.532 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 85.3 p -77.08 -23.77 51.89 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.273 0.229 . . . . 0.0 110.839 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -76.82 -35.51 57.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.248 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.19 -28.49 61.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 122.187 -0.321 . . . . 0.0 110.353 174.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.4 tp -73.09 -42.98 62.42 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.061 0.544 . . . . 0.0 111.17 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -70.2 -35.3 73.83 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.82 -21.85 63.35 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.57 -39.19 88.36 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.07 -26.94 73.63 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.761 -0.466 . . . . 0.0 112.309 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.347 10.6 m-85 -102.16 -1.23 31.83 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 119.437 3.125 . . . . 0.0 119.437 179.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 60.4 mt -135.79 -4.59 2.23 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.828 1.195 . . . . 0.0 114.137 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.92 143.89 47.54 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 119.962 1.255 . . . . 0.0 109.094 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.87 15.41 3.85 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.369 1.068 . . . . 0.0 113.341 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -70.06 139.04 52.55 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -73.93 136.9 43.33 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.822 -0.549 . . . . 0.0 111.942 -175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.4 mtm -83.57 152.56 24.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.894 0.478 . . . . 0.0 110.676 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.8 pttp . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.083 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.66 165.26 30.66 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.933 3.089 . . . . 0.0 111.414 177.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.91 142.35 50.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 102.825 -3.028 . . . . 0.0 102.825 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.7 143.53 42.07 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.4 tt -89.05 152.22 21.8 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.601 1.16 . . . . 0.0 108.95 173.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.488 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -139.95 150.75 44.9 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.023 -0.423 . . . . 0.0 110.777 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.27 162.05 40.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 22.3 p -165.49 168.27 16.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -54.94 129.58 38.21 Favored 'General case' 0 N--CA 1.457 -0.09 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.7 t -81.16 148.57 29.51 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -114.04 8.21 17.0 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 169.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.98 158.91 21.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.068 0.947 . . . . 0.0 111.744 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -91.84 -3.41 56.1 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.489 -178.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -154.53 172.77 17.27 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.553 0.741 . . . . 0.0 110.541 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.97 23.36 1.37 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.972 0.909 . . . . 0.0 109.802 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.253 1.255 0 CA-C-O 117.427 -1.273 . . . . 0.0 110.515 -176.416 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo . . . . . 0 N--CA 1.456 -0.731 0 N-CA-C 110.942 -0.445 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -142.99 157.24 44.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.89 0.476 . . . . 0.0 110.765 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.97 158.93 34.5 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.514 0.725 . . . . 0.0 110.948 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -73.74 -4.39 34.27 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -158.08 147.91 15.33 Favored Pre-proline 0 N--CA 1.456 -0.131 0 C-N-CA 123.177 0.591 . . . . 0.0 110.035 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.27 -15.22 47.47 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.908 2.406 . . . . 0.0 110.322 174.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.5 t -91.26 154.79 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.583 0.753 . . . . 0.0 112.752 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.8 tt -140.41 152.07 45.42 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 125.152 1.381 . . . . 0.0 108.297 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -134.8 134.34 40.76 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.452 0.301 . . . . 0.0 111.033 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -129.91 152.71 37.78 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.069 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -142.96 173.75 11.28 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 86.62 11.29 71.56 Favored Glycine 0 CA--C 1.527 0.808 0 O-C-N 122.242 -0.286 . . . . 0.0 112.48 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 41.2 mt -76.3 39.68 0.2 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.739 0.816 . . . . 0.0 110.998 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -74.34 18.67 0.15 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -136.98 156.27 48.65 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.943 0.497 . . . . 0.0 111.439 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 36.6 t -69.19 -15.38 63.38 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.52 0.728 . . . . 0.0 111.883 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -74.28 5.01 4.91 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 91.0 mmm -114.18 141.37 47.6 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.301 0.501 . . . . 0.0 110.782 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -162.36 168.02 22.83 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.568 1.147 . . . . 0.0 108.963 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 95.1 m -54.83 -32.11 60.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.902 0.481 . . . . 0.0 111.981 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.36 -38.6 60.0 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -66.39 -48.3 70.55 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -177.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.23 -49.41 84.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.451 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.268 1.4 m-85 -61.14 -56.87 15.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 178.025 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -57.44 -33.81 68.31 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.792 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.21 -64.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.572 0.5 OUTLIER -76.56 -5.52 48.01 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 176.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 50.5 t -74.77 -32.24 62.0 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.5 pp -63.3 -17.6 62.71 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.629 172.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -91.73 -8.83 45.8 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.73 -179.26 41.7 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 118.375 0.534 . . . . 0.0 112.455 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -80.67 129.99 34.84 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 122.599 -0.353 . . . . 0.0 110.958 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.451 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 0.8 OUTLIER -114.05 165.55 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.451 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -129.29 -63.34 0.95 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -154.42 158.81 40.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.295 0.952 . . . . 0.0 113.157 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . 0.416 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.5 p -138.52 150.94 24.09 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 C-N-CA 123.908 0.883 . . . . 0.0 110.267 -175.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -150.78 122.14 7.86 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.964 0.906 . . . . 0.0 110.417 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.259 6.6 m-85 -80.51 155.43 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 177.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 mmt -100.26 115.96 31.13 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.783 0.433 . . . . 0.0 110.949 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -79.15 -14.26 59.21 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.69 0.396 . . . . 0.0 111.341 172.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.7 p -85.0 -5.48 59.35 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.322 0.649 . . . . 0.0 112.251 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -126.21 156.73 71.83 Favored Pre-proline 0 CA--C 1.529 0.153 0 C-N-CA 123.554 0.741 . . . . 0.0 109.903 -177.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.63 -15.06 40.77 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.189 2.593 . . . . 0.0 111.592 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.19 92.07 0.08 OUTLIER Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.99 159.72 41.75 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.38 166.7 32.65 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.276 0.56 . . . . 0.0 110.578 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 41.1 ttp -129.49 147.43 51.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.275 1.03 . . . . 0.0 109.065 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.67 157.05 20.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -137.17 133.83 35.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 26.3 mtm -153.02 177.96 10.22 Favored 'General case' 0 C--O 1.23 0.078 0 C-N-CA 123.934 0.894 . . . . 0.0 109.957 -173.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.09 118.64 10.13 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 171.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -72.3 -33.3 67.3 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -168.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.69 -86.21 0.02 OUTLIER Glycine 0 C--N 1.335 0.524 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -177.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -74.5 -28.53 61.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.81 -34.06 18.4 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.984 -174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.4 t -88.76 -23.99 6.17 Favored 'Isoleucine or valine' 0 C--N 1.341 0.225 0 C-N-CA 118.828 -1.149 . . . . 0.0 109.47 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.83 -52.06 33.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.943 174.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -68.17 -32.7 73.13 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 121.874 -0.516 . . . . 0.0 112.386 -176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.67 -34.19 75.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 118.721 0.691 . . . . 0.0 110.584 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.53 -12.69 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.31 0.644 . . . . 0.0 110.731 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.7 m -92.42 -21.24 20.31 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -128.6 -28.17 2.53 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.72 -15.16 7.99 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 120.486 1.494 . . . . 0.0 114.447 -172.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.555 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.63 100.82 2.38 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 116.83 2.159 . . . . 0.0 116.83 -167.59 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.584 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 12.1 m-80 76.84 21.95 1.14 Allowed 'General case' 0 N--CA 1.482 1.144 0 O-C-N 117.743 -3.098 . . . . 0.0 113.199 -161.464 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -81.03 163.13 23.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.873 -1.142 . . . . 0.0 108.769 167.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -82.62 140.94 32.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.9 ttt -159.7 138.7 10.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.09 0.556 . . . . 0.0 110.15 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.419 46.4 m-85 57.03 20.71 5.64 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.91 70.67 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -134.19 -167.58 1.98 Allowed 'General case' 0 C--O 1.231 0.092 0 C-N-CA 124.326 1.05 . . . . 0.0 108.866 177.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -129.71 143.08 50.65 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.8 ptm -118.02 84.59 2.2 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.991 0.517 . . . . 0.0 110.393 -177.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.584 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 2.7 m-20 -54.44 128.4 31.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.779 -173.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.555 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.441 2.3 t -126.19 154.38 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 113.286 -3.366 . . . . 0.0 115.848 168.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 45.8 t -162.99 166.79 23.34 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.477 1.511 . . . . 0.0 108.716 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 10.2 t -68.61 145.16 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 O-C-N 121.855 -0.528 . . . . 0.0 112.084 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.4 t -84.41 155.99 22.01 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.635 0.374 . . . . 0.0 111.144 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -96.54 -9.62 29.1 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.51 -0.119 . . . . 0.0 110.711 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -76.31 148.51 80.77 Favored Pre-proline 0 N--CA 1.454 -0.264 0 C-N-CA 123.404 0.682 . . . . 0.0 110.658 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.22 -32.87 3.79 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.364 2.71 . . . . 0.0 111.617 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.81 157.89 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.286 0.634 . . . . 0.0 110.671 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 17.7 mt -82.58 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 49.7 mmm -93.9 119.78 66.54 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 122.476 0.31 . . . . 0.0 110.382 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.49 154.47 45.13 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.213 2.609 . . . . 0.0 109.337 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 154.53 -113.06 0.55 Allowed Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.38 163.49 27.91 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.499 0.666 . . . . 0.0 111.905 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 14.7 t -157.37 160.12 38.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.44 1.096 . . . . 0.0 109.632 -177.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -130.07 0.73 4.72 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.39 175.07 44.76 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 93.8 mt -143.41 157.03 44.79 Favored 'General case' 0 N--CA 1.458 -0.074 0 C-N-CA 124.235 1.014 . . . . 0.0 109.179 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -75.6 -8.04 55.77 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . 0.253 11.9 t0 -120.49 26.89 8.89 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 122.039 0.923 . . . . 0.0 112.665 175.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.51 -150.83 7.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 69.4 m -133.05 -16.9 2.45 Favored 'General case' 0 N--CA 1.458 -0.07 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.9 m -127.04 149.14 50.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.863 0.465 . . . . 0.0 111.368 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.9 p -89.77 7.19 38.15 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 110.137 173.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -139.77 148.64 42.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.993 1.317 . . . . 0.0 113.275 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -154.7 158.2 39.23 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.05 0.387 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -127.7 136.65 51.86 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -134.07 4.66 3.52 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -179.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -64.85 -22.01 66.91 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.127 0.571 . . . . 0.0 112.046 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -114.02 1.21 14.59 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.05 0.54 . . . . 0.0 111.777 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.9 m -75.73 149.81 37.96 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.023 0.44 . . . . 0.0 111.53 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -80.12 -11.14 59.78 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.157 0.583 . . . . 0.0 111.151 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -62.05 -23.93 66.78 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.155 0.582 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -60.89 128.68 37.68 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.832 0.453 . . . . 0.0 110.27 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -73.18 -33.64 65.54 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.349 61.0 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -63.87 -21.95 66.69 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -173.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -135.19 150.5 72.95 Favored Pre-proline 0 C--O 1.23 0.071 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.6 -25.45 24.69 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.24 2.627 . . . . 0.0 111.412 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -80.03 -22.55 42.26 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.01 -0.431 . . . . 0.0 110.509 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -82.21 -41.65 20.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 172.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.26 -20.08 63.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.653 0.381 . . . . 0.0 111.858 -178.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.65 -19.71 48.45 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.472 0.309 . . . . 0.0 111.759 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -123.97 2.25 8.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -61.44 156.34 19.5 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.482 0.583 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -140.03 137.13 34.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -175.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.3 mm -141.12 144.02 27.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 123.595 0.758 . . . . 0.0 109.119 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -147.93 167.87 23.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.554 0.741 . . . . 0.0 111.086 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -63.0 155.36 73.07 Favored Pre-proline 0 N--CA 1.455 -0.196 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 172.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -66.01 135.49 41.0 Favored 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.191 1.927 . . . . 0.0 108.456 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -154.12 173.71 15.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.77 0.428 . . . . 0.0 110.076 -172.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -83.79 -8.77 59.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.7 -0.19 . . . . 0.0 111.161 -178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.64 138.04 20.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.2 tp -139.18 151.22 46.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -123.02 149.37 44.44 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.771 0.828 . . . . 0.0 108.906 -178.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -143.99 159.13 43.13 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -152.55 167.76 27.77 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.363 -2.458 . . . . 0.0 104.363 -176.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 60.61 57.53 2.71 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.174 0.59 . . . . 0.0 112.231 -173.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -136.08 122.46 14.02 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-O 119.442 -0.314 . . . . 0.0 111.186 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.67 164.1 1.06 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.944 3.096 . . . . 0.0 113.279 172.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.42 -17.3 64.18 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.887 0.875 . . . . 0.0 112.062 -175.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -97.93 3.98 49.55 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 47.0 t -73.07 -18.17 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 511' ' ' GLU . 1.3 m -55.38 -177.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 117.638 -1.172 . . . . 0.0 113.813 -165.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.554 ' H ' HG23 ' A' ' 510' ' ' THR . 22.9 pt-20 -18.84 -44.53 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.254 1.822 . . . . 0.0 114.834 -169.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.0 mt-10 -57.06 -48.23 79.05 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 173.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -87.64 -28.36 21.9 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 121.968 2.167 . . . . 0.0 106.323 -173.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -61.88 -35.81 79.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -75.84 -42.72 48.83 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.07 -22.3 42.42 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.477 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.6 mt -75.58 -45.01 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.126 0 CA-C-N 118.417 0.553 . . . . 0.0 110.648 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 30.7 p -68.32 -32.11 72.01 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.045 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -64.77 -39.28 93.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.834 0.349 . . . . 0.0 111.924 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.5 tp10 -71.39 -28.58 64.13 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.584 0.353 . . . . 0.0 111.272 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.75 -4.74 59.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.233 0.613 . . . . 0.0 111.691 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.6 27.85 56.31 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.829 -0.429 . . . . 0.0 112.219 175.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 6.0 p -129.73 152.58 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 C-N-CA 123.263 0.625 . . . . 0.0 112.027 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -68.64 152.93 44.69 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 121.203 0.525 . . . . 0.0 111.802 -175.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -82.24 156.23 69.14 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.81 0.844 . . . . 0.0 110.607 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.24 153.21 77.93 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.261 2.641 . . . . 0.0 111.108 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -84.78 -15.49 44.78 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.8 t -153.5 160.85 42.63 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.37 149.37 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 C-N-CA 123.311 0.645 . . . . 0.0 109.491 -176.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -147.07 143.91 28.68 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.103 0.961 . . . . 0.0 108.816 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 4.7 t -138.83 143.2 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.058 0 C-N-CA 122.877 0.471 . . . . 0.0 111.998 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -152.89 -175.23 5.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.8 p -146.12 -171.5 3.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.886 0.874 . . . . 0.0 110.28 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 102.2 -10.18 56.59 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 123.97 0.795 . . . . 0.0 111.908 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -89.87 -27.22 20.05 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 117.597 0.699 . . . . 0.0 111.648 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 83.5 p -165.83 163.86 18.72 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.447 0.699 . . . . 0.0 109.581 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -97.04 -4.21 40.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.716 0.406 . . . . 0.0 110.914 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.63 -40.6 48.77 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 89.2 p -163.21 170.6 17.5 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.14 0.495 . . . . 0.0 111.052 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.0 p -83.27 174.2 10.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.33 0.652 . . . . 0.0 110.186 177.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.9 p -153.74 162.41 41.26 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.35 -170.5 43.34 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.057 -177.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.08 160.39 22.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.484 0.713 . . . . 0.0 110.288 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -138.66 161.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.932 1.293 . . . . 0.0 108.367 177.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.75 148.73 28.9 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.28 -0.262 . . . . 0.0 111.099 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 21.3 m-90 -127.87 173.19 10.2 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.715 1.206 . . . . 0.0 112.343 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -75.19 -10.36 59.4 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.617 0.367 . . . . 0.0 110.459 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -157.93 160.73 37.9 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 121.735 -0.603 . . . . 0.0 111.118 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -74.1 -22.34 59.52 Favored 'General case' 0 CA--C 1.527 0.089 0 O-C-N 122.386 -0.196 . . . . 0.0 110.942 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 88.3 p -77.78 -27.29 50.19 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -71.51 -35.93 70.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.4 56.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.0 tp -78.23 -41.73 33.37 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.398 0.279 . . . . 0.0 111.409 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -68.59 -39.04 81.09 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.2 m -67.7 -28.42 67.66 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.4 tt -71.22 -36.88 72.02 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.19 -32.04 75.14 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 119.632 -0.538 . . . . 0.0 111.831 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.326 9.8 m-85 -100.69 -14.5 18.07 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 119.114 3.005 . . . . 0.0 119.114 177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.69 -14.53 14.79 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.972 0.806 . . . . 0.0 112.031 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -70.09 140.93 52.81 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.397 0.999 . . . . 0.0 109.073 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.47 20.29 3.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.673 1.189 . . . . 0.0 112.856 -178.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.35 135.57 52.02 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -75.98 130.93 39.18 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.121 -0.362 . . . . 0.0 111.492 -176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 61.6 mtm -100.95 152.67 20.28 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 123.145 0.578 . . . . 0.0 111.421 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 C--O 1.232 0.179 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 169.993 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.4 p90 . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -79.58 167.67 20.6 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 123.757 2.971 . . . . 0.0 111.946 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -128.83 142.35 51.0 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 170.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.281 0.6 OUTLIER -85.99 137.95 32.34 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -175.805 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.0 134.99 37.72 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.546 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -128.75 149.52 50.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 118.483 0.583 . . . . 0.0 110.574 179.788 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.53 162.49 39.93 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.864 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 21.9 p -163.73 170.82 16.45 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.398 0.679 . . . . 0.0 110.909 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -56.12 125.09 20.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 37.2 t -80.81 151.97 28.48 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.2 t -114.64 7.09 15.91 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.41 1.084 . . . . 0.0 113.767 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.83 163.95 20.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.148 0.979 . . . . 0.0 111.96 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -97.69 -2.84 40.48 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.608 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -154.55 170.27 21.87 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.518 0.727 . . . . 0.0 110.17 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.88 23.55 1.38 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.193 0.597 . . . . 0.0 110.45 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 117.627 -1.177 . . . . 0.0 110.74 -176.401 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo . . . . . 0 N--CA 1.453 -0.886 0 N-CA-C 110.848 -0.481 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -146.57 159.8 42.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.311 0.645 . . . . 0.0 110.352 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.73 157.41 38.08 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.585 0.354 . . . . 0.0 111.234 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -79.62 -3.03 45.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.111 0.564 . . . . 0.0 110.544 -177.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 47.1 t -155.97 151.13 21.1 Favored Pre-proline 0 CA--C 1.532 0.267 0 O-C-N 121.498 -0.751 . . . . 0.0 111.341 -177.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.29 -4.3 3.95 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.473 3.449 . . . . 0.0 114.03 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 6.5 m -128.47 165.77 27.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.95 0.881 . . . . 0.0 109.892 -174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.65 159.57 41.96 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.937 1.695 . . . . 0.0 107.733 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.6 ttt -143.59 138.89 29.38 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.538 0.608 . . . . 0.0 111.145 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -121.19 154.44 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -175.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.44 171.09 14.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.1 13.13 72.23 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 122.141 -0.35 . . . . 0.0 112.302 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.28 28.34 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.747 0.819 . . . . 0.0 111.581 178.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -64.6 -26.33 68.36 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -76.84 149.44 36.17 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.064 0.459 . . . . 0.0 110.996 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.8 p -70.58 -6.73 38.73 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.615 0.766 . . . . 0.0 112.646 -176.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -77.95 -14.34 59.57 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.954 0.501 . . . . 0.0 112.021 -176.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 80.3 mmm -86.05 154.29 21.52 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.034 0.379 . . . . 0.0 111.23 -178.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -164.0 164.34 23.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.315 1.046 . . . . 0.0 108.509 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.0 p -64.03 -29.77 70.89 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.034 -0.416 . . . . 0.0 111.978 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.02 -26.86 36.09 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -70.96 -50.79 30.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.435 0.636 . . . . 0.0 109.606 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.15 -47.47 92.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . 0.449 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.264 1.3 m-85 -63.25 -52.35 62.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 178.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -59.42 -33.86 71.77 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 120.16 1.346 . . . . 0.0 109.458 -172.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 15.0 t -62.48 -61.88 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.561 0.8 OUTLIER -76.51 -4.98 45.57 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 176.216 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 52.9 t -75.26 -32.57 61.11 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.6 pp -62.41 -19.55 63.56 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.561 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.43 -9.31 52.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 116.919 2.192 . . . . 0.0 116.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 159.12 178.29 32.99 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 118.298 0.499 . . . . 0.0 112.234 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -68.51 140.21 55.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.449 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 18.2 m -114.01 165.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.918 1.287 . . . . 0.0 109.339 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -137.47 -60.71 0.66 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.81 154.7 37.78 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 118.738 0.699 . . . . 0.0 112.855 -175.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.9 146.72 19.73 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 C-N-CA 123.181 0.592 . . . . 0.0 109.976 176.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.2 133.07 13.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.632 0.373 . . . . 0.0 110.555 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.271 11.8 m-85 -80.38 149.6 30.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.7 mmt -75.01 131.95 40.99 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.135 0.493 . . . . 0.0 111.553 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -79.24 -25.5 42.59 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.879 0.871 . . . . 0.0 111.827 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 94.8 p -101.94 -6.78 23.06 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -113.89 152.74 45.92 Favored Pre-proline 0 CA--C 1.529 0.171 0 CA-C-N 118.507 0.594 . . . . 0.0 110.193 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.34 -15.9 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.463 2.776 . . . . 0.0 112.168 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 179.84 91.3 0.08 OUTLIER Glycine 0 C--N 1.337 0.611 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.84 159.91 35.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.639 0.775 . . . . 0.0 109.308 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.11 142.04 18.07 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.747 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.6 ptm -91.39 150.43 21.28 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.4 t -138.86 151.28 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.558 0.743 . . . . 0.0 112.13 -173.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -131.89 132.82 43.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 84.9 mtp -155.2 172.91 17.38 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.463 0.705 . . . . 0.0 109.691 -171.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.88 112.07 3.59 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.264 -2.125 . . . . 0.0 105.264 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -72.46 -33.41 67.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -166.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.74 -87.42 0.01 OUTLIER Glycine 0 CA--C 1.52 0.351 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -74.52 -27.3 60.48 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.11 -34.39 17.92 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.798 -174.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 96.6 t -85.92 -25.85 6.47 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 118.525 -1.27 . . . . 0.0 108.576 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -63.89 -52.63 59.06 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.316 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -68.91 -31.89 71.13 Favored 'General case' 0 N--CA 1.457 -0.088 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.95 -34.58 78.43 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.559 0.618 . . . . 0.0 110.219 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 41.5 mt -77.92 -13.98 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.463 0.705 . . . . 0.0 110.926 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.9 m -91.97 -22.03 20.22 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.46 -20.24 3.32 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -169.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 63.9 mt -134.48 -14.56 2.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.554 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.02 2.44 Favored 'General case' 0 C--O 1.198 -1.622 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 -169.368 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.572 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.3 m-80 76.87 22.06 1.12 Allowed 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.012 -2.93 . . . . 0.0 112.491 -161.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -85.79 162.93 18.45 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -78.72 141.94 37.48 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.8 ttt -162.03 137.85 7.61 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.262 0.625 . . . . 0.0 109.912 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.411 49.4 m-85 56.76 28.87 14.98 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.96 9.26 86.79 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -134.0 -167.67 1.99 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.036 1.334 . . . . 0.0 108.7 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -138.17 143.91 40.49 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.36 105.3 8.98 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.572 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 23.5 m-20 -64.08 132.02 49.25 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 115.709 -2.091 . . . . 0.0 111.729 -173.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.554 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.1 t -125.75 151.8 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 113.229 -3.388 . . . . 0.0 115.567 169.258 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -163.99 170.03 17.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.472 1.109 . . . . 0.0 108.568 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 5.5 t -69.85 144.31 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.9 t -87.66 153.88 21.03 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.057 0.543 . . . . 0.0 110.822 177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -101.89 1.37 36.83 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -73.87 156.21 88.26 Favored Pre-proline 0 N--CA 1.454 -0.233 0 C-N-CA 123.272 0.629 . . . . 0.0 110.036 176.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -75.87 -42.69 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.667 2.245 . . . . 0.0 111.019 176.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -171.04 164.7 7.51 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 124.196 0.998 . . . . 0.0 109.457 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.09 137.72 21.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 7.8 mmm -107.33 132.6 20.84 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 122.542 0.337 . . . . 0.0 110.691 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.1 158.61 45.39 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.228 2.619 . . . . 0.0 109.105 173.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.82 -133.1 3.59 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.368 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -72.55 158.79 35.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.599 0.76 . . . . 0.0 110.75 -176.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -151.2 169.45 21.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.433 0.693 . . . . 0.0 109.766 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -122.65 1.68 9.47 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.51 -175.14 54.95 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.35 162.39 36.57 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 124.387 1.075 . . . . 0.0 109.165 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 11.0 pm0 -70.08 -22.01 63.09 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -120.49 13.41 11.76 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -159.04 167.13 34.8 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 121.986 -0.446 . . . . 0.0 112.17 -176.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 t -86.35 -29.79 22.7 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.782 0.433 . . . . 0.0 111.777 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 87.4 m -127.06 151.52 48.5 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.008 0.523 . . . . 0.0 111.639 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 84.4 p -82.24 7.27 14.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.262 0.625 . . . . 0.0 110.728 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -134.04 147.5 50.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.312 1.445 . . . . 0.0 114.824 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -152.63 153.45 33.36 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.883 0.473 . . . . 0.0 110.315 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.256 0.1 OUTLIER -133.98 145.73 49.78 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -127.33 10.78 6.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 34.6 t -65.33 -22.59 66.84 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.259 0.624 . . . . 0.0 111.91 -174.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -114.05 2.04 14.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.045 0.538 . . . . 0.0 111.637 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -77.32 146.51 36.71 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.766 0.317 . . . . 0.0 111.372 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -79.25 -8.21 58.86 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.393 0.277 . . . . 0.0 110.87 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -63.08 -21.66 66.33 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -59.04 123.35 16.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.566 0.346 . . . . 0.0 110.125 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -80.97 -32.6 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -176.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.285 55.1 m-85 -97.96 14.26 27.94 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.4 p -74.61 -6.67 49.89 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.28 149.83 69.05 Favored Pre-proline 0 C--O 1.23 0.059 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -71.4 -24.72 22.34 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 123.235 2.623 . . . . 0.0 111.301 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -81.37 -23.97 37.35 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.066 0.394 . . . . 0.0 110.751 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -82.84 -41.81 18.59 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 173.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.21 -18.18 64.27 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.462 0.305 . . . . 0.0 111.579 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.11 -18.9 52.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.757 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -2.54 8.14 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.54 152.6 41.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.872 0.76 . . . . 0.0 110.772 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -150.91 138.61 19.75 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.9 mt -139.78 145.66 26.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 123.829 0.851 . . . . 0.0 108.909 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -145.3 173.48 11.93 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.6 0.76 . . . . 0.0 110.523 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -56.99 154.3 19.79 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.088 0.555 . . . . 0.0 109.558 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -63.5 148.75 92.34 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.701 2.267 . . . . 0.0 110.097 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.1 t -152.57 167.39 29.01 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.804 -174.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.66 -0.69 51.73 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 122.315 -0.241 . . . . 0.0 111.051 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 3.0 t -97.57 134.53 35.28 Favored 'Isoleucine or valine' 0 C--O 1.231 0.084 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -117.51 157.76 25.73 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.865 0.866 . . . . 0.0 109.136 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -129.37 136.97 50.67 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.166 0.986 . . . . 0.0 108.37 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -125.82 158.07 35.94 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -177.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -147.63 165.52 30.16 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 103.656 -2.72 . . . . 0.0 103.656 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.5 m120 57.95 57.42 4.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.882 0.473 . . . . 0.0 111.864 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -126.55 152.56 74.63 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.345 0.658 . . . . 0.0 110.322 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.72 162.59 40.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.728 2.286 . . . . 0.0 110.658 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.46 -16.56 63.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.202 0.601 . . . . 0.0 111.317 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -112.54 22.26 14.79 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.329 0.651 . . . . 0.0 111.388 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.3 p -65.93 -15.12 18.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -176.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.581 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.88 -177.23 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 117.793 -1.098 . . . . 0.0 113.863 -165.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.581 ' H ' HG23 ' A' ' 510' ' ' THR . 23.5 pt-20 -27.32 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -169.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.9 mt-10 -57.57 -47.86 80.93 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 117.545 -1.217 . . . . 0.0 114.244 170.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -86.0 -27.67 24.68 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-N 122.287 2.312 . . . . 0.0 106.346 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.52 -33.53 75.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 176.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -77.52 -41.19 40.1 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.13 -28.45 57.44 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.015 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 69.9 mt -73.32 -40.22 56.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.115 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.42 -30.17 70.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.83 -43.7 71.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -68.86 -22.08 64.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 O-C-N 122.17 -0.331 . . . . 0.0 111.837 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.88 -5.23 48.44 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.923 0.489 . . . . 0.0 111.321 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.08 4.73 60.18 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-O 119.655 -0.525 . . . . 0.0 113.782 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.02 162.44 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 CA-C-N 118.154 0.977 . . . . 0.0 112.98 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -73.34 143.86 46.74 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 174.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -71.92 149.3 92.47 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 122.823 0.449 . . . . 0.0 111.193 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.38 155.9 62.88 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.622 2.881 . . . . 0.0 110.733 177.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -86.0 -17.95 33.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.4 t -154.8 156.79 36.89 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.515 0.198 . . . . 0.0 110.995 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 96.5 t -145.06 145.6 20.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 123.879 0.872 . . . . 0.0 110.199 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -146.92 145.9 29.95 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 123.252 0.621 . . . . 0.0 109.833 175.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 7.9 t -143.7 144.55 23.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -177.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -153.78 -175.43 5.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 91.8 p -133.59 -178.99 5.25 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.543 0.737 . . . . 0.0 110.756 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 97.43 -7.22 63.69 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.862 0.744 . . . . 0.0 112.375 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -86.69 -34.84 19.6 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.715 0.757 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 39.7 t -167.18 158.39 12.0 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.963 0.505 . . . . 0.0 110.265 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -96.89 -7.97 32.03 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.2 -28.85 19.7 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.433 0.693 . . . . 0.0 111.549 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.9 p -160.56 155.91 24.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.245 0.545 . . . . 0.0 112.044 -178.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.5 t -84.22 171.98 12.29 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 66.7 m -146.75 163.64 35.32 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.631 1.172 . . . . 0.0 109.455 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.98 -173.11 46.05 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.61 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -122.39 160.39 25.55 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.597 0.759 . . . . 0.0 110.828 -177.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 70.4 mt -139.54 158.94 43.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.835 1.254 . . . . 0.0 108.48 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -150.76 147.5 27.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.936 0.335 . . . . 0.0 111.569 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -122.81 169.27 11.28 Favored 'General case' 0 C--N 1.338 0.073 0 C-N-CA 124.867 1.267 . . . . 0.0 112.633 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -76.42 -8.24 56.72 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.887 0.475 . . . . 0.0 110.861 -176.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.9 t -156.26 158.44 37.52 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 121.708 -0.62 . . . . 0.0 111.165 -178.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.01 -30.01 67.22 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.384 0.273 . . . . 0.0 111.192 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 71.8 m -79.34 -26.33 42.14 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 110.483 -0.192 . . . . 0.0 110.483 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -72.52 -30.98 64.97 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 121.042 0.449 . . . . 0.0 111.355 174.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.92 -28.04 55.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.864 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 51.6 tp -79.93 -35.2 38.11 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.439 0.296 . . . . 0.0 111.455 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -74.41 -38.35 63.1 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.725 -0.609 . . . . 0.0 109.414 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.263 0.3 OUTLIER -72.45 -21.41 61.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 175.38 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.64 -36.05 78.08 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 170.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.42 -43.96 95.99 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.253 6.6 m-85 -85.64 -18.63 32.69 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -178.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -106.56 -12.76 15.51 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.935 0.789 . . . . 0.0 112.396 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -74.98 141.05 44.03 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.239 0.927 . . . . 0.0 109.269 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 55.07 19.24 2.67 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.294 1.037 . . . . 0.0 112.636 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.253 39.9 t80 -73.24 139.2 46.05 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -72.5 125.42 27.39 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 122.309 0.243 . . . . 0.0 110.868 -176.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 75.3 mtm -83.52 152.69 24.78 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.686 0.395 . . . . 0.0 111.926 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.424 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 N--CA 1.455 -0.191 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.0 160.12 43.53 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.948 3.099 . . . . 0.0 111.717 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -129.92 142.39 50.66 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 102.677 -3.083 . . . . 0.0 102.677 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.258 0.7 OUTLIER -77.37 138.37 39.27 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 179.078 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.3 tt -83.14 151.85 25.54 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.539 ' HZ1' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -137.42 150.42 47.63 Favored 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.546 178.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -157.25 165.15 36.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 111.184 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 28.8 p -158.99 170.37 22.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.45 0.7 . . . . 0.0 109.713 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -56.48 125.71 23.26 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 177.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.1 t -86.64 152.42 22.59 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -169.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -111.7 10.13 20.98 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.34 14.18 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 124.046 0.938 . . . . 0.0 111.836 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.8 mm-40 -92.01 -3.92 55.19 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.98 178.36 3.44 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.636 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.76 32.01 1.43 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.349 0.26 . . . . 0.0 111.63 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.43 -1.271 . . . . 0.0 110.701 -178.959 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 N--CA 1.454 -0.837 0 N-CA-C 109.825 -0.875 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . 0.417 ' HA ' ' HA2' ' A' ' 426' ' ' GLY . 41.1 p-80 -154.63 157.91 38.9 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.321 0.581 . . . . 0.0 112.182 -178.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.64 166.24 23.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.95 0.9 . . . . 0.0 111.391 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.22 -8.28 53.89 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -159.49 147.35 13.28 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 122.725 0.41 . . . . 0.0 110.985 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -13.75 36.16 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 123.565 2.843 . . . . 0.0 110.965 173.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -86.22 146.43 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -134.88 155.04 51.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.5 1.12 . . . . 0.0 108.488 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.31 134.83 34.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -174.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.07 150.46 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.097 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -139.96 176.31 8.85 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 105.254 -2.128 . . . . 0.0 105.254 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 81.74 11.84 82.31 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 116.417 -0.356 . . . . 0.0 112.426 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 62.7 mt -79.29 22.76 0.41 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.652 0.726 . . . . 0.0 112.131 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -65.17 -25.64 67.82 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -175.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -66.92 157.06 34.19 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.395 0.617 . . . . 0.0 111.599 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 81.6 p -79.05 27.39 0.24 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.75 1.22 . . . . 0.0 112.23 -172.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.87 4.23 4.15 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.294 0.638 . . . . 0.0 112.696 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 39.9 mmm -102.37 141.89 34.46 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.729 0.3 . . . . 0.0 110.201 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -154.27 152.64 30.53 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.211 0.604 . . . . 0.0 109.47 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -57.68 -37.07 72.83 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -71.3 -38.47 71.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.247 0.476 . . . . 0.0 112.184 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -76.02 -45.58 33.76 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.147 0.579 . . . . 0.0 112.233 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.61 -42.36 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -75.91 -29.93 58.59 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.764 -170.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -76.97 -30.88 56.18 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.893 1.224 . . . . 0.0 109.845 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.54 -55.75 19.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 N-CA-C 106.405 -1.702 . . . . 0.0 106.405 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.541 5.4 p90 -76.6 -4.91 45.41 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 173.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.63 -30.52 61.68 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.924 -0.485 . . . . 0.0 110.624 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.0 pp -62.34 -16.3 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.301 -0.559 . . . . 0.0 111.152 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -87.53 -7.33 57.7 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.55 -172.28 44.84 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.226 -178.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -85.03 121.04 27.23 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.082 0.553 . . . . 0.0 109.816 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.5 9.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -130.16 -59.92 1.03 Allowed 'General case' 0 C--N 1.339 0.144 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -144.14 169.77 17.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.859 1.208 . . . . 0.0 112.51 -177.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.0 p -147.24 144.13 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 125.057 1.343 . . . . 0.0 108.24 175.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -154.39 124.16 6.67 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 117.961 0.346 . . . . 0.0 111.438 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.263 5.9 m-85 -72.68 155.24 40.2 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 35.9 mmt -84.92 128.73 34.75 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.271 0.629 . . . . 0.0 111.64 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -18.29 53.29 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 84.1 p -101.95 1.59 36.91 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -126.89 152.03 74.74 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 118.342 0.519 . . . . 0.0 110.623 -175.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.0 -15.6 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.535 2.823 . . . . 0.0 111.441 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.63 94.96 0.1 OUTLIER Glycine 0 C--N 1.338 0.66 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.54 160.0 31.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.651 0.78 . . . . 0.0 109.208 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.15 144.67 14.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 77.6 mtp -84.7 154.2 22.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.712 0.805 . . . . 0.0 109.335 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 38.1 t -147.48 152.12 13.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -134.21 139.88 46.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.114 -0.366 . . . . 0.0 110.06 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.4 ptp -164.14 172.49 13.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.273 1.029 . . . . 0.0 110.047 -174.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.33 126.77 28.55 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.91 -34.03 66.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -169.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 375' ' ' HIS . . . -58.68 -85.79 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -178.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -64.15 -37.42 87.41 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.46 -35.96 17.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.401 -0.809 . . . . 0.0 112.876 -171.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.2 t -83.18 -28.29 7.87 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 CA-C-N 120.242 1.383 . . . . 0.0 109.153 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -68.71 -47.29 66.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.753 177.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -68.12 -36.87 80.43 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -176.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.69 77.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.944 0.793 . . . . 0.0 109.814 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 46.9 mt -76.48 -14.81 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 122.826 0.45 . . . . 0.0 110.85 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 55.4 m -97.24 -17.42 19.84 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -130.27 -26.13 2.37 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 116.29 1.959 . . . . 0.0 116.29 -169.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.61 -11.09 2.4 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 120.532 1.515 . . . . 0.0 114.27 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.549 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.96 101.18 2.62 Favored 'General case' 0 C--O 1.198 -1.615 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 -168.091 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.563 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.4 m-80 77.19 21.47 1.08 Allowed 'General case' 0 N--CA 1.483 1.221 0 O-C-N 117.381 -3.325 . . . . 0.0 112.763 -163.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.21 159.67 28.4 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.536 -0.728 . . . . 0.0 110.002 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -74.33 136.79 42.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 115.675 1.731 . . . . 0.0 115.675 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' MET . . . . . 0.417 ' HE1' ' CE2' ' A' ' 442' ' ' PHE . 19.4 ttt -157.96 140.9 14.94 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.351 0.661 . . . . 0.0 109.531 -176.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.417 ' CE2' ' HE1' ' A' ' 441' ' ' MET . 40.6 m-85 59.44 17.5 6.03 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.73 10.22 85.42 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -174.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -132.39 -162.26 1.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.509 1.523 . . . . 0.0 108.31 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -135.36 146.97 48.91 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 122.646 0.378 . . . . 0.0 110.812 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.63 99.93 5.34 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 176.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.563 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.2 m120 -65.22 131.33 46.22 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 115.746 -2.073 . . . . 0.0 112.487 -171.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.549 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.449 2.1 t -125.91 152.13 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 112.62 -3.632 . . . . 0.0 115.809 168.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.8 t -162.96 171.26 16.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.778 1.231 . . . . 0.0 108.462 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.2 p -76.18 146.95 8.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.2 t -86.33 156.86 20.05 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.066 0.547 . . . . 0.0 111.01 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -92.55 -8.51 44.17 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 111.179 0.066 . . . . 0.0 111.179 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -77.49 150.43 79.55 Favored Pre-proline 0 CA--C 1.529 0.144 0 C-N-CA 123.458 0.703 . . . . 0.0 110.637 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.58 -32.95 1.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.411 2.74 . . . . 0.0 112.484 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.03 159.89 11.57 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.364 0.666 . . . . 0.0 110.343 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 39.1 mt -91.09 122.68 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 39.1 mmm -76.11 160.48 78.12 Favored Pre-proline 0 N--CA 1.456 -0.158 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 170.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -49.11 117.56 2.92 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.752 2.301 . . . . 0.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -78.49 135.44 15.83 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 -169.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -78.32 164.13 25.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 168.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 33.4 t -143.78 159.12 43.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.961 0.8 . . . . 0.0 112.966 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -143.91 2.98 1.22 Allowed 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -177.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.4 -178.83 53.33 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 123.332 0.491 . . . . 0.0 112.009 -176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.7 mt -143.53 158.7 43.45 Favored 'General case' 0 C--N 1.334 -0.099 0 C-N-CA 123.631 0.772 . . . . 0.0 109.109 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -68.73 -14.26 62.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.21 0.204 . . . . 0.0 111.428 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -120.43 27.25 8.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.694 0.798 . . . . 0.0 111.536 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -176.58 -154.46 11.83 Favored Glycine 0 C--N 1.337 0.613 0 O-C-N 121.549 -0.719 . . . . 0.0 111.35 -178.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -132.97 -11.43 2.96 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.0 t -127.08 156.03 42.36 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.036 0.534 . . . . 0.0 110.279 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.1 p -122.7 3.74 9.52 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.598 0.759 . . . . 0.0 112.304 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -142.92 141.73 31.55 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 124.818 1.247 . . . . 0.0 114.331 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -155.13 156.68 36.21 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.963 -0.46 . . . . 0.0 111.382 -177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -119.84 132.54 55.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.695 1.198 . . . . 0.0 112.943 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -122.25 3.39 9.79 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 98.0 p -68.9 -17.57 63.99 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.568 0.347 . . . . 0.0 111.299 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -113.96 -1.58 13.77 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.306 0.642 . . . . 0.0 111.594 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.3 t -75.22 146.98 40.72 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.405 0.282 . . . . 0.0 110.941 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -76.29 -17.37 59.48 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.455 0.302 . . . . 0.0 110.792 178.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -65.74 -23.62 66.78 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.486 0.315 . . . . 0.0 110.787 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -68.49 113.55 6.13 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . 0.539 HH11 ' HG2' ' A' ' 481' ' ' ARG . 6.8 ttt-85 -81.08 -29.96 34.82 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 116.818 -0.173 . . . . 0.0 111.409 -172.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -89.01 7.46 34.68 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.1 t -71.38 -18.93 62.33 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.19 149.93 71.39 Favored Pre-proline 0 C--O 1.232 0.137 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.13 -24.52 27.91 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.026 2.484 . . . . 0.0 111.681 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -81.35 -22.68 38.24 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.164 0.438 . . . . 0.0 110.9 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.56 -39.21 17.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 122.097 -0.377 . . . . 0.0 110.019 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -69.01 -20.47 64.15 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.116 0.566 . . . . 0.0 111.443 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.42 -16.96 60.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.068 -0.395 . . . . 0.0 111.732 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -124.09 31.64 5.76 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.118 0.567 . . . . 0.0 111.773 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.89 156.84 6.2 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.311 0.577 . . . . 0.0 112.034 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.23 97.58 3.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.5 mm -137.12 136.9 47.08 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.04 0 C-N-CA 122.845 0.458 . . . . 0.0 110.096 -174.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -152.09 173.42 14.93 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 110.21 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -57.28 156.58 14.69 Favored Pre-proline 0 CA--C 1.531 0.22 0 C-N-CA 123.454 0.702 . . . . 0.0 109.928 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.13 150.82 87.54 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 122.947 2.431 . . . . 0.0 110.007 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.0 t -155.07 166.54 33.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 -174.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -83.71 -0.91 52.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.656 0.382 . . . . 0.0 110.55 179.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -96.27 138.19 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 177.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.1 mt -123.14 155.01 37.87 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.07 0.548 . . . . 0.0 109.662 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -119.14 142.12 48.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -136.55 158.94 43.25 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 121.506 0.67 . . . . 0.0 110.2 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -150.9 168.76 23.52 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 104.181 -2.526 . . . . 0.0 104.181 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 57.54 57.51 4.29 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.864 0.465 . . . . 0.0 110.847 -174.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -135.54 110.54 10.45 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.356 0.262 . . . . 0.0 110.826 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.66 165.78 1.59 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 124.693 3.595 . . . . 0.0 113.162 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 16.4 mt -68.37 -16.46 63.93 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.006 -176.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.93 -10.6 50.07 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -81.61 -13.88 12.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -171.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.493 HG23 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.86 178.89 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -167.405 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.493 ' H ' HG23 ' A' ' 510' ' ' THR . 87.1 tt0 4.56 -64.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.541 1.936 . . . . 0.0 114.671 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.3 mt-10 -57.06 -43.0 81.62 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.9 -27.0 21.28 Favored 'General case' 0 C--N 1.35 0.6 0 CA-C-N 122.667 2.485 . . . . 0.0 105.712 -176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -60.12 -37.64 80.63 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.63 -1.228 . . . . 0.0 113.275 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.57 -49.67 52.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -79.61 -21.42 44.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.83 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 57.0 mt -71.93 -40.4 68.2 Favored 'Isoleucine or valine' 0 C--N 1.338 0.099 0 CA-C-N 119.006 0.821 . . . . 0.0 109.589 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 98.7 m -64.58 -33.99 77.2 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.688 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -63.29 -40.26 96.87 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -73.73 -9.34 58.56 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.655 0.382 . . . . 0.0 111.997 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 87.9 mt -107.86 -2.66 19.67 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.452 0.701 . . . . 0.0 111.606 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.08 -13.23 5.83 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.593 -0.56 . . . . 0.0 113.431 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 35.4 m -81.48 154.8 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.088 0 CA-C-N 118.191 0.996 . . . . 0.0 109.26 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -75.8 148.73 38.22 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.062 -0.399 . . . . 0.0 111.336 -176.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 53.3 ptt85 -70.79 156.23 92.28 Favored Pre-proline 0 CA--C 1.53 0.177 0 C-N-CA 123.277 0.631 . . . . 0.0 109.936 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.26 151.29 83.8 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.238 2.625 . . . . 0.0 110.959 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.5 t -87.11 -14.95 39.88 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 23.2 t -151.46 154.86 37.41 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 122.489 0.316 . . . . 0.0 110.639 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 57.8 t -143.62 146.38 21.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 C-N-CA 123.702 0.801 . . . . 0.0 110.187 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -147.26 141.61 26.33 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.488 0.715 . . . . 0.0 109.476 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -137.37 149.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.75 -172.44 4.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 92.0 p -140.83 -177.25 4.99 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.54 0.736 . . . . 0.0 110.628 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.6 -8.76 66.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 123.825 0.726 . . . . 0.0 112.142 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.51 -27.01 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.83 0.815 . . . . 0.0 111.017 177.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 80.2 p -165.07 165.75 19.72 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.414 0.686 . . . . 0.0 109.619 176.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.4 pm0 -96.85 -5.72 37.58 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.057 0.543 . . . . 0.0 110.915 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -77.61 -47.43 19.35 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 88.1 p -163.05 172.65 14.65 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.145 0.498 . . . . 0.0 110.929 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 42.1 t -77.41 167.3 21.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.336 0.589 . . . . 0.0 111.174 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 91.9 p -148.48 163.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.32 -165.87 36.55 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 119.772 -1.204 . . . . 0.0 113.485 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.88 159.23 25.94 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.809 0.844 . . . . 0.0 110.474 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.1 mt -137.71 155.39 49.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.953 1.301 . . . . 0.0 108.134 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -145.8 147.42 31.84 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 118.147 0.43 . . . . 0.0 111.498 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -124.67 171.08 10.35 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.929 1.292 . . . . 0.0 112.075 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -73.07 -12.22 60.83 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 47.4 t -157.52 164.48 37.32 Favored 'General case' 0 C--O 1.231 0.119 0 O-C-N 121.806 -0.559 . . . . 0.0 111.097 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -70.78 -29.2 65.33 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.477 0.311 . . . . 0.0 110.713 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 82.3 p -76.25 -26.34 55.89 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 178.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.35 -36.93 74.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.968 0.507 . . . . 0.0 111.476 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.53 -28.51 56.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.465 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 52.0 tp -74.03 -40.88 62.57 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.23 -0.294 . . . . 0.0 111.235 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.64 -36.81 73.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.622 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 2.5 m -70.31 -27.71 64.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 176.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -65.23 -39.27 92.51 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.04 -47.22 75.33 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -84.51 -27.09 27.64 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 27.6 tp -93.66 -20.0 20.59 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -69.99 149.88 47.26 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.315 0.507 . . . . 0.0 110.211 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 57.31 22.65 7.98 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.738 1.215 . . . . 0.0 113.122 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -65.44 134.75 54.14 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 177.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -76.61 121.08 22.7 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.476 0.31 . . . . 0.0 110.707 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 68.3 mtm -90.4 152.62 20.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 123.131 0.573 . . . . 0.0 109.969 172.472 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.67 164.51 35.47 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.298 2.665 . . . . 0.0 111.002 176.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -129.94 142.32 50.66 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 102.997 -2.964 . . . . 0.0 102.997 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.25 0.8 OUTLIER -84.96 140.3 31.18 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 115.321 1.601 . . . . 0.0 115.321 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.7 tt -78.26 147.14 34.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.576 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -132.28 147.97 52.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.401 -0.519 . . . . 0.0 110.619 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.26 164.01 38.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.234 0.54 . . . . 0.0 111.245 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 24.6 p -162.24 175.33 11.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.269 1.028 . . . . 0.0 110.038 -178.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -57.97 125.83 24.82 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.9 t -81.83 150.64 27.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -172.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.27 0.7 OUTLIER -114.54 10.3 16.82 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.852 1.426 . . . . 0.0 114.852 169.836 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.63 163.4 21.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.215 1.006 . . . . 0.0 111.906 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -96.95 -0.78 46.96 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.437 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -155.09 168.56 26.61 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.629 0.772 . . . . 0.0 110.293 -178.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.92 20.46 1.44 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.492 0.717 . . . . 0.0 110.381 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.457 -1.259 . . . . 0.0 110.765 -175.564 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.455 -0.785 0 N-CA-C 111.183 -0.353 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -155.2 158.54 39.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.165 0.586 . . . . 0.0 110.422 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.83 160.61 31.88 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.873 0.368 . . . . 0.0 111.237 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -73.98 -6.6 48.34 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.3 t -158.85 146.93 13.7 Favored Pre-proline 0 N--CA 1.456 -0.138 0 C-N-CA 122.759 0.424 . . . . 0.0 110.49 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -12.74 34.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.492 2.795 . . . . 0.0 110.742 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.51 148.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 C-N-CA 122.846 0.458 . . . . 0.0 112.182 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.9 tt -140.28 155.71 46.74 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 14.5 tpt -139.05 131.61 28.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.241 0.473 . . . . 0.0 110.811 -174.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.26 155.12 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.8 175.11 10.43 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -176.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.24 9.62 81.7 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.071 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.81 26.79 0.4 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.467 0.707 . . . . 0.0 112.461 -177.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.6 -40.74 97.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . 0.408 ' H ' ' CD ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.43 148.61 51.62 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.122 0.487 . . . . 0.0 111.201 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 67.3 m -70.08 -8.02 46.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -72.93 -15.4 61.57 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 122.58 0.352 . . . . 0.0 111.455 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 51.6 mmm -90.72 148.0 22.88 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.924 0.392 . . . . 0.0 110.814 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -162.23 159.75 26.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.296 1.038 . . . . 0.0 108.284 175.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.9 p -59.92 -30.77 69.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -74.99 -37.04 61.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.048 0.386 . . . . 0.0 111.779 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -70.81 -51.5 26.37 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 122.726 0.41 . . . . 0.0 110.231 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 38.1 t -69.08 -43.03 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.138 0.575 . . . . 0.0 109.743 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.29 -29.48 57.41 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -73.79 -33.67 64.32 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 120.124 1.329 . . . . 0.0 109.839 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 17.6 t -57.31 -57.06 11.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.272 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.558 2.8 p90 -76.49 -4.03 40.48 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 117.758 2.503 . . . . 0.0 117.758 175.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.37 -33.15 58.91 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.881 -0.512 . . . . 0.0 111.085 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -60.81 -14.86 24.4 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -84.51 -9.78 58.03 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.17 -151.71 15.35 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.354 0.525 . . . . 0.0 112.233 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -99.57 126.15 45.5 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.551 0.34 . . . . 0.0 110.961 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.02 165.47 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.86 -62.76 1.22 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -144.28 161.17 39.6 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -169.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.14 150.32 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.45 1.1 . . . . 0.0 109.162 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -157.47 132.42 8.76 Favored 'General case' 0 CA--C 1.527 0.096 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.8 m-85 -82.89 163.66 20.98 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -122.43 123.14 40.63 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 122.838 0.455 . . . . 0.0 111.959 -177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.006 0.523 . . . . 0.0 111.254 169.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.9 p -77.91 -7.76 57.18 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.292 0.637 . . . . 0.0 112.432 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -132.13 159.47 72.04 Favored Pre-proline 0 CA--C 1.529 0.147 0 C-N-CA 124.131 0.973 . . . . 0.0 109.319 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -16.43 54.87 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.92 2.413 . . . . 0.0 111.013 177.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 173.5 101.16 0.14 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.25 158.55 39.01 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.428 0.691 . . . . 0.0 109.75 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.19 153.88 29.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.008 0.433 . . . . 0.0 110.985 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.3 ttm -107.39 151.19 25.84 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.024 0.929 . . . . 0.0 108.749 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.7 t -136.83 152.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 123.299 0.639 . . . . 0.0 111.599 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -132.12 128.93 39.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.2 mtp -152.53 171.11 18.62 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -170.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.92 125.65 26.61 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -73.31 -29.63 62.83 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -63.94 -83.65 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 -178.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -72.66 -36.48 67.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.72 -33.32 18.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 119.944 1.247 . . . . 0.0 114.151 -169.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 52.5 t -88.88 -24.49 6.0 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.13 1.332 . . . . 0.0 109.858 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -70.84 -50.83 31.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -65.11 -35.21 80.4 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.36 77.55 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.576 0.625 . . . . 0.0 110.552 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 72.6 mt -79.91 -9.1 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.088 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 26.0 m -98.85 -20.18 16.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.17 -29.52 2.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -169.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.06 -13.09 7.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.623 1.556 . . . . 0.0 113.56 -173.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.569 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.7 p-10 -71.62 100.79 2.36 Favored 'General case' 0 C--O 1.201 -1.46 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -167.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.547 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 11.3 m-80 76.65 22.04 1.21 Allowed 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 123.666 2.939 . . . . 0.0 113.207 -162.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -79.25 163.19 25.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.494 -0.754 . . . . 0.0 109.425 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.39 135.94 36.27 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' MET . . . . . 0.44 ' HE2' ' CE2' ' A' ' 442' ' ' PHE . 19.6 ttt -157.67 142.61 16.7 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . 0.44 ' CE2' ' HE2' ' A' ' 441' ' ' MET . 57.5 m-85 59.55 18.5 7.07 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 116.53 2.048 . . . . 0.0 116.53 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.31 11.38 85.39 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 -174.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -134.51 -162.86 1.3 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.439 1.496 . . . . 0.0 108.474 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -136.86 149.72 47.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.95 0.405 . . . . 0.0 111.023 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 13.9 ptm -127.45 83.59 2.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.116 0.966 . . . . 0.0 108.873 178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.547 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.2 m120 -55.92 127.96 32.83 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-O 115.759 -2.067 . . . . 0.0 112.21 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.569 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.43 2.0 t -128.54 152.66 36.98 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 113.48 -3.288 . . . . 0.0 116.51 169.208 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -160.3 167.44 27.49 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.375 1.47 . . . . 0.0 107.974 177.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.23 146.4 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.5 t -83.03 166.02 19.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.827 0.451 . . . . 0.0 111.253 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.16 12.48 7.12 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -85.33 151.85 57.1 Favored Pre-proline 0 N--CA 1.456 -0.151 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.05 -36.56 4.21 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.789 2.326 . . . . 0.0 112.506 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.89 158.78 7.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.764 0.425 . . . . 0.0 111.42 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -75.31 130.53 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.5 mmm -97.08 118.6 64.59 Favored Pre-proline 0 N--CA 1.454 -0.254 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.512 175.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.19 163.45 32.69 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.167 2.578 . . . . 0.0 109.772 175.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.52 -144.52 12.35 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -72.45 152.32 42.03 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.373 0.669 . . . . 0.0 109.83 -179.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 89.1 p -151.92 166.19 32.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.989 0.424 . . . . 0.0 111.439 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -84.63 -4.42 58.99 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.68 -177.69 51.35 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.7 mt -141.85 157.44 45.0 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.977 0.911 . . . . 0.0 108.996 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -75.37 -12.03 60.17 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.364 -0.21 . . . . 0.0 111.452 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -120.4 26.64 9.07 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.668 0.787 . . . . 0.0 110.122 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.92 -154.19 8.56 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -177.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 41.6 t -133.05 -26.11 1.74 Allowed 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.613 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 98.0 m -127.01 155.96 42.38 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.485 0.714 . . . . 0.0 110.338 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.4 p -75.93 -23.08 55.42 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -95.26 148.49 22.36 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -157.15 157.49 34.54 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.088 0.555 . . . . 0.0 109.901 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -134.35 153.19 52.03 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -128.01 2.67 5.9 Favored 'General case' 0 CA--C 1.527 0.091 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.3 p -66.07 -17.73 64.88 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.6 0.36 . . . . 0.0 111.762 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.05 2.07 14.83 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.405 0.682 . . . . 0.0 111.321 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 479' ' ' ASN . 39.9 t -82.33 -7.85 59.63 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.962 0.505 . . . . 0.0 112.014 -176.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 62.4 -7.96 0.12 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.126 1.37 . . . . 0.0 113.155 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . 0.504 HD22 ' CD2' ' A' ' 561' ' ' HIS . 63.9 m-20 -65.56 -15.8 63.07 Favored 'General case' 0 C--O 1.231 0.093 0 O-C-N 121.685 -0.635 . . . . 0.0 112.581 -178.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -55.56 125.34 20.61 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -72.97 -33.77 66.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -169.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.376 57.1 m-85 -98.19 8.15 45.22 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 117.946 2.573 . . . . 0.0 117.946 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.7 t -76.16 -13.78 60.18 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -132.44 149.56 73.46 Favored Pre-proline 0 C--O 1.231 0.087 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -71.58 -23.87 22.7 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.28 2.653 . . . . 0.0 111.624 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.56 -25.34 53.95 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.133 0.424 . . . . 0.0 110.317 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -86.68 -48.29 8.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -65.18 -19.53 66.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.476 0.71 . . . . 0.0 112.765 -171.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.62 -29.22 62.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.243 0.474 . . . . 0.0 111.388 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -124.06 10.25 8.77 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -60.46 154.51 20.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.663 0.665 . . . . 0.0 112.719 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -155.34 138.71 15.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 47.2 mt -142.12 142.74 27.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 C-N-CA 123.449 0.7 . . . . 0.0 109.511 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -148.27 173.39 13.07 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 123.801 0.841 . . . . 0.0 110.336 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -58.73 153.9 39.21 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.296 0.638 . . . . 0.0 110.049 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.22 147.44 88.07 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 123.087 2.525 . . . . 0.0 110.267 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.4 t -152.67 174.49 13.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.388 0.675 . . . . 0.0 109.771 -174.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -83.68 -0.64 51.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -178.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -99.71 136.45 30.9 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.4 ' CD2' ' HB2' ' A' ' 552' ' ' ALA . 4.6 mm? -121.14 156.23 32.79 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.805 0.842 . . . . 0.0 109.644 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -127.1 142.35 51.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -136.6 158.95 43.24 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.305 0.574 . . . . 0.0 111.257 -176.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -150.16 164.49 35.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.403 -2.814 . . . . 0.0 103.403 -177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 34.0 m120 58.53 56.79 4.11 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.949 0.5 . . . . 0.0 111.104 -172.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -122.02 151.94 59.06 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.724 0.41 . . . . 0.0 111.174 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.57 154.26 37.45 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.467 2.778 . . . . 0.0 112.118 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.78 -16.55 63.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.98 0.512 . . . . 0.0 111.675 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -122.83 27.71 7.6 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 123.701 0.8 . . . . 0.0 110.968 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.8 p -63.64 -17.01 19.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.593 HG21 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.54 -177.91 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -164.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.593 ' H ' HG21 ' A' ' 510' ' ' THR . 22.7 pt-20 -21.34 -41.77 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.794 1.638 . . . . 0.0 115.215 -169.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.6 -47.2 82.81 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 172.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -86.3 -27.01 24.62 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 121.709 2.049 . . . . 0.0 106.631 -173.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -67.12 -36.26 81.52 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -76.84 -38.65 53.38 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -73.58 -28.66 61.96 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.398 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.66 -44.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 O-C-N 121.966 -0.459 . . . . 0.0 110.969 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 31.2 p -69.12 -25.44 64.4 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.183 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.96 -42.46 85.16 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -70.41 -18.3 63.02 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 70.8 mt -96.07 -6.01 39.62 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.653 0.381 . . . . 0.0 111.415 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.59 -11.87 3.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.875 0.75 . . . . 0.0 113.769 177.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 24.1 m -77.79 159.37 4.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 118.194 0.997 . . . . 0.0 110.45 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -68.9 153.68 43.36 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.113 0.482 . . . . 0.0 111.627 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -76.08 157.03 83.76 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.48 0.712 . . . . 0.0 110.692 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.26 160.09 51.2 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.343 2.696 . . . . 0.0 111.015 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -95.25 -15.75 22.98 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.1 t -154.22 159.99 41.61 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 122.793 0.437 . . . . 0.0 110.313 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.29 150.08 12.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -145.6 141.06 27.83 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 124.0 0.92 . . . . 0.0 109.071 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 25.0 t -139.9 141.46 34.12 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 C-N-CA 123.524 0.729 . . . . 0.0 110.023 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.67 167.23 29.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 -177.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 36.7 t -89.76 170.72 10.19 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.654 0.782 . . . . 0.0 110.763 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . 0.453 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 92.27 -178.07 39.9 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 123.751 0.691 . . . . 0.0 112.048 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 41.0 mttm 62.53 -12.08 0.07 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.083 1.753 . . . . 0.0 113.698 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' SER . . . . . 0.453 ' H ' ' C ' ' A' ' 534' ' ' GLY . 44.5 t -165.6 162.02 18.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.451 0.701 . . . . 0.0 110.466 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -116.95 -5.78 11.46 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.376 0.67 . . . . 0.0 110.104 174.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -91.98 -31.32 15.66 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.747 0.819 . . . . 0.0 112.275 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.7 p -159.11 168.92 25.4 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 121.089 0.471 . . . . 0.0 111.563 -171.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 32.9 t -89.5 170.93 10.09 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.847 0.859 . . . . 0.0 110.97 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.5 t -148.65 159.87 43.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.245 1.018 . . . . 0.0 109.186 178.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.71 -171.79 44.42 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.001 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 159.8 27.05 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.813 0.845 . . . . 0.0 110.441 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.0 mt -140.87 159.22 42.68 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.675 1.19 . . . . 0.0 108.859 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -150.32 148.74 29.2 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 122.102 -0.374 . . . . 0.0 111.745 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -126.72 171.36 11.25 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.106 1.362 . . . . 0.0 112.075 178.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -74.59 -10.41 59.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.59 0.356 . . . . 0.0 110.567 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.2 t -157.66 157.13 32.99 Favored 'General case' 0 C--O 1.231 0.123 0 O-C-N 121.698 -0.626 . . . . 0.0 110.444 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -75.04 -19.69 59.91 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.019 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.1 m -80.84 -29.45 35.86 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 118.188 0.449 . . . . 0.0 110.181 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.99 -36.47 72.49 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 121.41 0.624 . . . . 0.0 111.219 171.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . 0.4 ' HB2' ' CD2' ' A' ' 500' ' ' LEU . . . -72.22 -27.01 62.26 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.663 177.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.2 tp -79.82 -45.22 19.13 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.596 0.358 . . . . 0.0 111.539 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.5 -33.46 75.97 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -73.81 -28.15 61.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 175.304 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tt -70.38 -35.18 73.34 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 171.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -57.36 -49.45 72.74 Favored Glycine 0 C--N 1.335 0.519 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.305 35.1 m-85 -84.07 -11.78 56.16 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.395 2.739 . . . . 0.0 118.395 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.15 -20.68 14.07 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.823 0.738 . . . . 0.0 112.859 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -70.64 139.39 51.31 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 119.315 0.962 . . . . 0.0 109.532 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.504 ' CD2' HD22 ' A' ' 479' ' ' ASN . 2.4 t-80 55.96 17.12 2.43 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.031 1.332 . . . . 0.0 113.444 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 32.7 t80 -72.68 139.4 47.25 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -69.7 140.76 53.57 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.958 -0.464 . . . . 0.0 112.193 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.4 mtm -83.57 152.66 24.74 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.921 0.391 . . . . 0.0 111.362 175.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 172.176 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.82 159.17 48.94 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.381 2.721 . . . . 0.0 111.196 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -130.01 142.32 50.64 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 102.731 -3.062 . . . . 0.0 102.731 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.263 0.6 OUTLIER -76.55 141.46 41.17 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 -176.271 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.41 138.15 32.99 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.3 1.44 . . . . 0.0 107.658 173.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.519 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -130.31 150.08 51.71 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 118.091 0.405 . . . . 0.0 110.308 -178.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.25 162.79 40.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.173 0.511 . . . . 0.0 111.247 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.6 p -158.57 167.6 29.16 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.823 0.849 . . . . 0.0 110.378 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -56.0 122.91 12.69 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.1 t -80.12 153.38 28.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -169.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 t -119.05 12.43 12.73 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.16 0.984 . . . . 0.0 113.434 169.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.03 20.19 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.138 0.975 . . . . 0.0 111.88 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -92.62 -3.49 54.88 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.571 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -153.9 171.49 18.9 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.75 0.82 . . . . 0.0 110.436 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.63 24.91 0.97 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.471 0.708 . . . . 0.0 110.198 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.604 -1.188 . . . . 0.0 110.439 -176.629 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 N--CA 1.454 -0.834 0 CA-C-O 121.09 0.371 . . . . 0.0 112.724 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -150.17 155.71 40.27 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.016 0.526 . . . . 0.0 110.569 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.83 161.15 29.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -76.61 -8.83 58.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.771 0.428 . . . . 0.0 110.272 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -157.29 147.77 16.03 Favored Pre-proline 0 CA--C 1.527 0.086 0 O-C-N 121.7 -0.625 . . . . 0.0 110.74 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.91 -17.21 46.57 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.239 2.626 . . . . 0.0 110.539 173.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.1 151.49 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -141.38 155.12 45.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.676 1.19 . . . . 0.0 108.338 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 43.9 tpp -136.63 137.52 40.19 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.343 0.257 . . . . 0.0 110.827 -176.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -131.69 150.91 34.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -138.04 175.69 9.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 12.34 77.73 Favored Glycine 0 CA--C 1.528 0.892 0 N-CA-C 112.014 -0.434 . . . . 0.0 112.014 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.22 25.95 0.57 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.343 0.657 . . . . 0.0 111.655 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -64.86 -40.21 94.79 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -176.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -67.94 147.85 51.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.0 0.429 . . . . 0.0 110.582 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 49.9 m -70.54 -8.47 51.64 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -72.95 -17.19 61.5 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.124 0.42 . . . . 0.0 111.42 178.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 66.3 mmm -85.18 148.14 26.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.088 0.403 . . . . 0.0 110.588 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.38 155.52 22.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.9 p -61.29 -30.56 70.56 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -72.45 -39.46 67.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.763 0.316 . . . . 0.0 110.559 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -76.06 -41.18 51.48 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 t -71.06 -43.65 75.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -75.1 -30.01 60.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -78.23 -28.31 47.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.018 1.281 . . . . 0.0 110.234 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.53 -57.02 13.43 Favored 'Isoleucine or valine' 0 C--N 1.341 0.222 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.551 1.6 p90 -76.65 -5.71 49.03 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.37 -32.27 68.29 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 117.973 0.351 . . . . 0.0 110.609 177.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -62.59 -14.99 48.97 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 120.321 -0.551 . . . . 0.0 111.279 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -90.5 -2.16 57.91 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 117.811 2.523 . . . . 0.0 117.811 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.0 -170.16 40.59 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.748 0.703 . . . . 0.0 113.054 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -83.07 132.62 35.11 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.54 -0.388 . . . . 0.0 110.797 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.94 165.53 8.82 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.096 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -177.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -122.49 -68.83 0.86 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.423 0.289 . . . . 0.0 111.522 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -154.54 174.44 14.93 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.219 0.463 . . . . 0.0 112.091 -177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.47 149.94 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 C-N-CA 124.426 1.09 . . . . 0.0 109.531 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -155.27 130.21 9.38 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.854 0.461 . . . . 0.0 111.314 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.279 3.7 m-85 -80.98 152.09 28.15 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 178.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 34.7 mmt -73.5 134.17 43.8 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-O 121.111 0.481 . . . . 0.0 111.808 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -79.21 -33.96 43.29 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.898 0.879 . . . . 0.0 111.974 178.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 70.7 m -102.05 -17.91 15.85 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -174.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -91.74 150.27 40.59 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 118.445 0.566 . . . . 0.0 110.562 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.18 -12.81 23.42 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.668 2.912 . . . . 0.0 112.432 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.82 81.42 0.06 OUTLIER Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.334 -0.706 . . . . 0.0 111.334 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.69 161.34 39.85 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.062 0.545 . . . . 0.0 109.87 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.95 149.28 19.54 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 78.5 mtp -93.6 151.51 19.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.973 0.909 . . . . 0.0 109.588 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.0 t -143.9 154.24 15.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -138.71 133.79 32.72 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 28.1 mtm -153.24 175.59 12.9 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 124.238 1.015 . . . . 0.0 109.5 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -64.45 123.57 19.56 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 172.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -72.43 -32.41 66.3 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -167.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.83 -89.39 0.01 OUTLIER Glycine 0 C--N 1.339 0.705 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -71.68 -29.12 64.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.47 -35.15 18.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.765 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 55.8 t -89.3 -26.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 118.319 -1.352 . . . . 0.0 109.447 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -68.56 -49.27 60.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.064 175.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -70.41 -31.37 68.54 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.66 78.31 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.876 0.762 . . . . 0.0 110.213 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.04 -15.59 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.121 0.569 . . . . 0.0 110.882 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.7 m -91.01 -20.66 21.86 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -123.46 -29.55 3.77 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 -169.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.0 mt -134.42 -5.53 2.59 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -171.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' ASN . . . . . 0.555 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.65 100.99 2.42 Favored 'General case' 0 C--O 1.204 -1.341 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -169.225 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . 0.531 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 11.9 m-80 77.21 22.06 1.02 Allowed 'General case' 0 N--CA 1.483 1.216 0 O-C-N 117.713 -3.117 . . . . 0.0 113.019 -160.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -83.08 156.96 23.04 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.946 -1.096 . . . . 0.0 109.752 167.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.252 21.8 m-85 -74.71 142.59 44.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 28.2 ttt -161.51 140.16 9.66 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.433 0.693 . . . . 0.0 109.901 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.386 47.7 m-85 56.83 27.21 12.57 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 117.77 2.508 . . . . 0.0 117.77 -179.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.7 7.56 88.12 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -133.71 -163.49 1.37 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.953 1.301 . . . . 0.0 108.211 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -138.88 146.33 41.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.29 107.31 10.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 447' ' ' ASN . . . . . 0.531 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 3.6 m-20 -69.35 133.92 48.42 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 115.653 -2.118 . . . . 0.0 111.813 -171.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 448' ' ' VAL . . . . . 0.555 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.465 2.0 t -125.11 151.18 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 113.191 -3.404 . . . . 0.0 115.132 168.44 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.7 t -161.48 165.98 27.85 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.807 1.243 . . . . 0.0 108.269 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.1 p -70.98 148.32 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.9 t -85.52 159.79 19.82 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.963 0.505 . . . . 0.0 110.969 177.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -105.13 0.02 27.04 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 121.948 0.099 . . . . 0.0 111.144 177.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -82.16 149.68 62.9 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.46 0.704 . . . . 0.0 110.507 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.02 -34.27 2.31 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.225 2.617 . . . . 0.0 112.148 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.11 158.75 12.43 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.366 0.666 . . . . 0.0 110.452 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.7 mt -85.09 135.86 23.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 174.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 60.4 mmm -98.8 156.69 35.3 Favored Pre-proline 0 N--CA 1.454 -0.258 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.24 118.69 5.11 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.883 2.388 . . . . 0.0 110.418 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -84.77 142.8 20.3 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 -176.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -77.74 125.6 29.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.6 p -77.79 153.39 32.89 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.864 0.364 . . . . 0.0 111.194 -176.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -139.83 -5.82 1.32 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.87 118.32 0.24 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.278 0.942 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.3 mt -77.36 160.22 28.94 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -69.3 -15.42 63.34 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 122.126 -0.359 . . . . 0.0 111.671 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -120.47 24.9 10.11 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.29 0.636 . . . . 0.0 110.186 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.94 -160.31 12.24 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 121.698 -0.626 . . . . 0.0 111.698 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 71.9 m -132.97 -5.54 3.11 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 95.1 m -127.03 155.67 42.86 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.162 0.585 . . . . 0.0 110.778 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.1 m -121.23 4.34 10.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.165 0.586 . . . . 0.0 110.34 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -144.82 147.77 33.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.517 1.127 . . . . 0.0 112.619 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -154.15 154.25 33.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.189 0.449 . . . . 0.0 111.374 -177.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -128.41 139.83 52.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.216 1.006 . . . . 0.0 113.387 -177.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -126.59 5.46 6.81 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 40.9 t -64.26 -27.03 68.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.713 0.405 . . . . 0.0 111.663 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -100.85 -1.36 34.92 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 122.918 0.487 . . . . 0.0 111.601 178.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.9 t -81.56 149.57 28.59 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.125 -0.36 . . . . 0.0 111.457 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -87.5 -4.94 58.99 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.215 0.606 . . . . 0.0 111.208 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -63.34 -19.15 64.37 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -62.18 109.15 1.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.199 0.6 . . . . 0.0 109.606 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -73.99 -29.27 61.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.305 69.7 m-85 -97.98 15.14 24.95 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.3 t -74.22 -14.76 60.98 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -131.06 148.37 70.0 Favored Pre-proline 0 C--O 1.233 0.214 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -177.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -72.27 -26.25 17.77 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.278 2.652 . . . . 0.0 112.063 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -79.09 -27.93 43.02 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.495 0.589 . . . . 0.0 110.007 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -77.28 -43.97 31.39 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 175.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.48 -19.24 63.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.69 -18.1 42.13 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 -1.48 8.26 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.28 162.05 15.5 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.257 0.551 . . . . 0.0 111.673 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.16 140.98 27.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.562 0.745 . . . . 0.0 109.75 178.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 33.5 mm -143.8 138.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -149.55 173.38 13.68 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.512 0.725 . . . . 0.0 110.361 -177.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -58.74 155.06 32.7 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -64.54 151.79 84.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.839 2.359 . . . . 0.0 109.351 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -154.51 169.17 24.43 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.793 0.437 . . . . 0.0 110.042 -174.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -83.77 -8.03 59.33 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.92 145.18 8.6 Favored 'Isoleucine or valine' 0 C--N 1.339 0.112 0 C-N-CA 123.34 0.656 . . . . 0.0 111.887 173.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.0 tp -138.05 153.16 49.36 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -126.95 148.38 50.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.678 0.791 . . . . 0.0 109.103 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -144.53 160.77 40.58 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.555 0.693 . . . . 0.0 109.746 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -152.75 164.9 36.9 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 104.01 -2.589 . . . . 0.0 104.01 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 59.11 57.6 3.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.919 0.488 . . . . 0.0 111.971 -173.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.44 153.52 53.85 Favored Pre-proline 0 CA--C 1.532 0.268 0 C-N-CA 123.042 0.537 . . . . 0.0 110.454 177.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.07 159.19 54.11 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.373 2.049 . . . . 0.0 110.229 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.46 -16.53 63.93 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.603 0.361 . . . . 0.0 111.498 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -109.27 19.04 19.86 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.248 0.619 . . . . 0.0 111.449 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 3.8 p -63.26 -18.91 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.079 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -175.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.577 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.86 -177.38 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 117.852 -1.07 . . . . 0.0 113.772 -165.541 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' GLU . . . . . 0.577 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -25.92 -37.9 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -169.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.2 mt-10 -58.21 -48.08 81.48 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 117.142 -1.409 . . . . 0.0 114.451 171.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -86.63 -27.14 24.0 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 122.529 2.422 . . . . 0.0 106.686 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -65.09 -38.59 91.2 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 176.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -74.88 -37.84 62.04 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -80.43 -22.05 41.57 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.542 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 50.3 mt -76.38 -43.89 35.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.418 0.554 . . . . 0.0 110.671 177.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 29.3 p -69.28 -33.92 73.95 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.729 0.695 . . . . 0.0 110.307 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -72.46 -26.2 61.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.2 tp10 -75.27 -26.71 58.99 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.284 0.234 . . . . 0.0 110.626 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -95.96 -2.9 46.11 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.231 0.613 . . . . 0.0 111.738 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 77.06 -1.19 64.45 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 123.416 0.532 . . . . 0.0 112.832 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.92 151.6 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 CA-C-N 117.995 0.897 . . . . 0.0 111.74 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -67.15 150.18 49.49 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.017 0.437 . . . . 0.0 110.38 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -76.98 152.61 82.54 Favored Pre-proline 0 CA--C 1.531 0.221 0 C-N-CA 123.012 0.525 . . . . 0.0 110.716 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.93 156.85 61.88 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.533 2.822 . . . . 0.0 110.631 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -89.71 -18.09 27.06 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 37.8 t -154.64 160.64 41.55 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 120.494 0.188 . . . . 0.0 110.842 176.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.81 146.54 9.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -177.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -147.23 141.13 25.86 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.051 0.941 . . . . 0.0 109.068 172.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.77 151.86 28.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -155.81 177.24 11.62 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 38.0 t -141.95 165.54 27.17 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.566 0.746 . . . . 0.0 109.859 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 123.96 -19.46 7.35 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.679 0.657 . . . . 0.0 111.636 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -80.24 -23.92 40.53 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.645 0.722 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 47.6 t -164.86 157.46 16.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.764 0.826 . . . . 0.0 109.487 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -97.0 -4.71 39.29 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.431 0.292 . . . . 0.0 110.257 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -78.13 -36.53 47.75 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.9 p -161.11 167.69 25.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.436 0.636 . . . . 0.0 112.325 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 48.4 t -85.56 164.99 17.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.223 1.009 . . . . 0.0 110.738 176.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 93.6 p -150.21 162.44 40.47 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.217 1.007 . . . . 0.0 108.414 177.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.94 -169.01 42.15 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.663 -178.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -121.12 160.23 24.15 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.978 0.911 . . . . 0.0 110.423 -177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.6 mt -142.12 163.97 31.43 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.14 1.376 . . . . 0.0 109.047 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -153.69 147.28 25.1 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.331 -0.231 . . . . 0.0 111.33 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.4 m-90 -126.15 172.53 9.95 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.164 1.386 . . . . 0.0 112.33 177.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -73.5 -7.78 53.22 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 39.9 t -159.64 162.05 35.11 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 122.963 0.505 . . . . 0.0 110.674 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -69.29 -30.94 69.14 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.346 -0.221 . . . . 0.0 110.55 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.6 m -75.65 -23.36 56.3 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 122.087 0.155 . . . . 0.0 110.784 178.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -74.09 -36.36 64.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.016 0.436 . . . . 0.0 111.66 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.04 -26.39 56.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.292 176.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.9 tp -78.46 -37.55 43.22 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.367 0.267 . . . . 0.0 111.421 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -72.68 -38.25 67.64 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.16 -27.14 63.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 175.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -66.94 -41.73 86.46 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 172.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.17 -31.63 79.64 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 119.691 -0.505 . . . . 0.0 112.307 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.273 6.2 m-85 -94.52 -10.0 33.57 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 177.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 89.6 mt -119.86 -8.94 9.78 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -70.48 139.15 51.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.516 1.053 . . . . 0.0 109.289 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 58.75 17.83 5.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.997 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 29.2 t80 -68.89 138.34 54.59 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -74.0 136.6 43.19 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.782 -0.574 . . . . 0.0 112.29 -174.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.0 mtm -83.64 152.69 24.66 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.026 0.53 . . . . 0.0 111.79 175.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 170.477 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.0 p90 . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.39 167.23 27.82 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.589 2.859 . . . . 0.0 110.71 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -129.96 142.38 50.65 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 102.178 -3.267 . . . . 0.0 102.178 175.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.285 0.6 OUTLIER -82.42 138.48 34.41 Favored 'General case' 0 C--O 1.23 0.062 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -173.79 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -81.17 137.52 35.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.279 1.431 . . . . 0.0 107.694 172.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' LYS . . . . . 0.512 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -130.89 147.47 52.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -178.581 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.46 161.1 40.08 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.946 0.403 . . . . 0.0 111.083 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.73 173.68 12.57 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.8 0.84 . . . . 0.0 110.33 -177.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -53.98 124.5 15.69 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 36.6 t -77.02 153.4 34.5 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 -171.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.261 1.0 OUTLIER -123.62 9.07 8.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.719 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.96 163.87 16.29 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.494 0.718 . . . . 0.0 110.704 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -82.83 0.58 43.31 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.41 165.37 1.4 Allowed 'General case' 0 C--O 1.23 0.029 0 C-N-CA 124.536 1.134 . . . . 0.0 110.196 175.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -84.29 -6.68 59.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.394 -1.289 . . . . 0.0 111.294 -179.483 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.306 35.1 t80 . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -73.77 167.86 54.29 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -71.38 176.19 8.32 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.617 3.545 . . . . 0.0 110.978 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -145.4 157.94 43.93 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.917 0.487 . . . . 0.0 110.851 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.75 156.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -76.37 0.88 17.93 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -157.43 146.72 15.0 Favored Pre-proline 0 CA--C 1.53 0.18 0 C-N-CA 122.741 0.417 . . . . 0.0 110.699 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.74 -10.7 29.85 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 123.239 2.626 . . . . 0.0 111.073 173.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.98 155.77 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.617 0.767 . . . . 0.0 112.386 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -137.98 154.4 49.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.333 1.053 . . . . 0.0 109.309 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 82.3 mmm -126.01 142.41 51.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 123.399 0.68 . . . . 0.0 111.836 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -136.24 148.69 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -140.74 174.28 10.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.55 10.11 82.24 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 45.3 mt -80.45 25.96 0.39 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.531 0.732 . . . . 0.0 112.239 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.51 -39.78 94.42 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -67.58 150.62 48.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.122 0.487 . . . . 0.0 111.217 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 87.6 p -69.06 -8.75 48.04 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -77.27 -17.06 58.69 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 117.92 0.327 . . . . 0.0 111.3 -176.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 65.4 mmm -88.29 145.43 25.85 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.943 0.338 . . . . 0.0 110.422 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -160.92 158.32 27.98 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.8 p -60.28 -30.93 69.78 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -174.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -70.4 -41.54 72.85 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 177.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.96 -42.47 48.34 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.52 -174.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -69.37 -43.01 81.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -176.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.28 -30.81 57.94 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.025 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -76.97 -30.77 56.12 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.914 1.234 . . . . 0.0 110.101 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.84 -55.76 21.84 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.559 1.3 p90 -76.51 -4.72 44.19 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 117.679 2.474 . . . . 0.0 117.679 173.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . 0.481 ' HG ' HG11 ' A' ' 406' ' ' VAL . 41.1 t -72.74 -32.36 65.62 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 122.144 -0.347 . . . . 0.0 110.414 176.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.39 -17.19 52.97 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.49 177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -88.5 -4.53 58.59 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.99 176.03 33.65 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-N 118.605 0.639 . . . . 0.0 112.431 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.93 134.22 49.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 122.539 -0.389 . . . . 0.0 111.698 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.481 HG11 ' HG ' ' A' ' 401' ' ' CYS . 1.2 m -114.02 165.47 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 124.614 1.166 . . . . 0.0 113.65 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -121.49 -65.36 1.14 Allowed 'General case' 0 N--CA 1.457 -0.077 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.183 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -154.47 167.02 31.44 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.1 p -138.64 150.24 23.91 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 C-N-CA 124.031 0.933 . . . . 0.0 110.136 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -151.41 125.4 9.2 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.066 0.547 . . . . 0.0 110.988 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -85.3 157.65 20.51 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.3 ptp -136.39 135.64 38.94 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 121.948 0.88 . . . . 0.0 112.487 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -79.13 -5.7 54.77 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 126.061 1.744 . . . . 0.0 112.769 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.8 t -77.76 -4.12 44.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.918 0.326 . . . . 0.0 111.823 -171.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.43 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 44.0 mmtm -141.74 157.36 65.02 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 124.159 0.983 . . . . 0.0 109.255 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.42 -11.91 33.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.177 2.585 . . . . 0.0 112.037 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.86 93.3 0.09 OUTLIER Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 175.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.5 162.78 39.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.788 0.435 . . . . 0.0 110.708 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.33 170.87 21.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.963 0.505 . . . . 0.0 110.243 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 21.6 ptm -131.97 152.23 51.24 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.695 0.798 . . . . 0.0 109.181 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.4 t -138.55 150.49 24.05 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.208 0 C-N-CA 123.184 0.594 . . . . 0.0 112.236 -173.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -129.06 131.09 47.27 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 46.0 mtp -152.87 174.89 13.52 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.588 0.755 . . . . 0.0 109.439 -170.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -67.66 115.5 7.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.5 p30 -72.24 -32.6 66.85 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -167.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.94 -86.47 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -74.65 -27.08 60.27 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 117.125 2.268 . . . . 0.0 117.125 -176.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.84 -35.2 17.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.074 -174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.8 t -86.41 -27.21 6.07 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 CA-C-N 119.776 1.171 . . . . 0.0 108.818 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -66.19 -50.79 62.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.036 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -70.35 -30.56 67.55 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.54 -33.92 76.75 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.65 0.659 . . . . 0.0 110.168 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 52.5 mt -80.1 -16.84 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.472 0.709 . . . . 0.0 110.782 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -90.22 -19.71 23.85 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -126.14 -28.53 3.13 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 91.2 mt -134.38 -8.35 2.56 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.54 1.518 . . . . 0.0 114.911 -170.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.546 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.06 2.45 Favored 'General case' 0 C--O 1.202 -1.418 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.573 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 15.4 m-80 79.4 20.75 0.66 Allowed 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 124.281 3.219 . . . . 0.0 114.058 -161.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -75.71 162.99 27.75 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.065 -1.022 . . . . 0.0 110.641 167.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -80.0 140.16 36.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 175.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.1 ttt -160.41 138.4 9.84 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.831 0.852 . . . . 0.0 109.957 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 52.6 m-85 56.99 24.21 9.22 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.59 9.46 86.4 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.661 -0.575 . . . . 0.0 111.661 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -135.18 -168.91 2.27 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.905 1.282 . . . . 0.0 108.716 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -122.0 151.85 40.37 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.653 0.263 . . . . 0.0 111.221 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 10.5 ptm -127.25 75.74 1.61 Allowed 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 124.873 1.269 . . . . 0.0 109.203 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.8 m120 -53.35 128.1 27.19 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 115.482 -2.199 . . . . 0.0 112.266 -173.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.428 2.0 t -126.64 150.87 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.439 -3.304 . . . . 0.0 115.76 168.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -164.74 170.27 15.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.645 1.178 . . . . 0.0 109.71 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.0 t -74.53 145.54 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 45.4 t -86.15 170.04 12.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.55 0.74 . . . . 0.0 111.414 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -115.98 0.72 13.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.554 0.342 . . . . 0.0 110.479 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -76.24 150.15 82.61 Favored Pre-proline 0 CA--C 1.53 0.183 0 C-N-CA 123.685 0.794 . . . . 0.0 110.94 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.91 -38.48 1.22 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.953 2.435 . . . . 0.0 111.522 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.93 159.54 7.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.719 0.808 . . . . 0.0 110.213 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 50.8 mt -78.36 143.94 11.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.077 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 82.1 mtp -120.22 130.37 24.88 Favored Pre-proline 0 CA--C 1.528 0.112 0 CA-C-N 117.622 0.192 . . . . 0.0 111.498 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.34 170.09 20.07 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 124.033 3.155 . . . . 0.0 109.612 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.17 -123.91 1.78 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -72.42 157.89 36.79 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.035 0.534 . . . . 0.0 109.738 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 91.9 p -151.93 174.08 14.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.834 0.454 . . . . 0.0 110.273 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.97 3.25 4.05 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.82 -175.05 54.65 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -176.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 78.7 mt -143.94 166.46 24.9 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.332 1.053 . . . . 0.0 109.328 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.81 -30.42 68.98 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 122.304 -0.248 . . . . 0.0 110.821 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -120.46 13.7 11.84 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -147.41 163.12 28.73 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 -178.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.8 t -86.57 -32.34 20.71 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.66 0.384 . . . . 0.0 111.703 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.5 m -127.1 155.63 43.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.3 0.64 . . . . 0.0 111.296 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.9 p -79.17 3.31 18.09 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.7 0.4 . . . . 0.0 110.778 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -136.04 149.71 48.89 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -152.99 151.83 30.72 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.39 0.276 . . . . 0.0 110.597 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -121.58 137.83 54.57 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -130.89 4.34 4.5 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 94.7 p -66.76 -16.09 64.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.104 0.562 . . . . 0.0 111.997 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -114.08 1.29 14.57 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.117 0.567 . . . . 0.0 111.322 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.5 t -77.96 149.0 34.2 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.785 0.434 . . . . 0.0 111.483 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -81.69 -8.02 59.66 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.737 0.415 . . . . 0.0 110.87 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . 0.445 HD22 ' CD2' ' A' ' 561' ' ' HIS . 6.5 m-20 -62.38 -21.58 65.46 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 122.386 0.274 . . . . 0.0 111.695 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -61.91 112.77 2.45 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -30.05 59.94 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.286 66.6 m-85 -97.98 11.94 35.84 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 179.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -74.53 -13.83 60.73 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -134.58 149.27 70.45 Favored Pre-proline 0 C--N 1.338 0.102 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.78 -24.73 21.08 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 123.211 2.607 . . . . 0.0 111.797 -177.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -76.84 -16.78 59.33 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.232 0.469 . . . . 0.0 110.584 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 63.1 mm-40 -92.53 -45.71 7.98 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 173.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.13 -18.69 61.6 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.798 0.439 . . . . 0.0 112.177 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.12 -22.79 44.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -124.09 -0.66 8.34 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -61.4 156.8 18.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.377 0.535 . . . . 0.0 111.143 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -150.85 139.75 20.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.4 mm -140.61 138.18 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.725 0.81 . . . . 0.0 109.293 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -150.21 173.37 14.01 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.625 0.77 . . . . 0.0 110.052 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -60.51 152.86 63.91 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 122.926 0.49 . . . . 0.0 109.908 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.61 159.34 51.38 Favored 'Trans proline' 0 N--CA 1.449 -1.124 0 C-N-CA 123.209 2.606 . . . . 0.0 110.352 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 93.9 p -156.59 177.52 11.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -83.75 -2.67 56.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.03 143.41 11.26 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 123.756 0.822 . . . . 0.0 112.376 175.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.32 149.61 47.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -120.41 151.39 39.36 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.517 0.727 . . . . 0.0 109.199 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -144.0 159.32 42.8 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.41 0.624 . . . . 0.0 112.018 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -149.17 167.76 25.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 102.99 -2.967 . . . . 0.0 102.99 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 56.68 57.49 4.74 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 122.226 -0.296 . . . . 0.0 111.182 -174.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -128.91 152.07 78.5 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.859 0.464 . . . . 0.0 110.597 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.78 154.51 31.48 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.515 2.81 . . . . 0.0 113.132 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.4 -16.48 63.93 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.494 0.718 . . . . 0.0 111.66 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -122.95 24.75 8.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.441 0.696 . . . . 0.0 110.835 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.03 -9.56 10.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -175.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.57 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.73 -177.32 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -165.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.57 ' H ' HG21 ' A' ' 510' ' ' THR . 23.2 pt-20 -28.64 -35.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.8 mt-10 -58.87 -46.3 88.14 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 116.915 -1.517 . . . . 0.0 114.553 170.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -87.66 -27.6 22.36 Favored 'General case' 0 C--N 1.354 0.792 0 CA-C-N 122.826 2.557 . . . . 0.0 106.861 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -66.65 -32.45 73.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.65 -46.26 39.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -76.44 -24.4 53.92 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.626 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.6 mt -74.91 -44.38 45.04 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 118.588 0.631 . . . . 0.0 110.203 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 86.4 m -66.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.53 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -69.54 -24.02 63.66 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -77.47 -30.89 53.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.266 0.227 . . . . 0.0 110.668 175.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 94.0 mt -86.17 -3.66 59.01 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.028 0.531 . . . . 0.0 111.141 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.04 -3.11 62.59 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 123.35 0.5 . . . . 0.0 112.377 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.8 t -77.36 148.47 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 CA-C-N 117.696 0.748 . . . . 0.0 111.825 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.94 133.97 51.99 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -75.37 152.67 85.82 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.727 0.411 . . . . 0.0 110.03 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -65.06 153.18 79.53 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.335 2.69 . . . . 0.0 111.579 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -83.88 -14.75 50.35 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 33.5 t -152.36 153.8 34.35 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 122.478 0.311 . . . . 0.0 110.321 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 60.9 t -145.81 145.94 19.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.44 0.696 . . . . 0.0 110.958 -175.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -146.45 145.23 30.15 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.645 0.778 . . . . 0.0 109.461 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 10.7 t -143.52 144.21 23.62 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.72 -173.08 4.44 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.9 p -139.05 -179.24 5.73 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.95 0.9 . . . . 0.0 110.157 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.37 -9.62 67.14 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 123.74 0.686 . . . . 0.0 112.232 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -88.51 -26.26 22.13 Favored 'General case' 0 C--N 1.338 0.109 0 CA-C-N 117.816 0.808 . . . . 0.0 110.281 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.4 t -165.62 152.66 10.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.908 0.883 . . . . 0.0 109.441 177.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -97.12 -6.02 35.96 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.526 0.33 . . . . 0.0 110.49 175.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.83 -26.64 16.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.177 0.591 . . . . 0.0 111.509 -176.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 25.9 t -159.66 161.8 35.03 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.143 0.429 . . . . 0.0 111.261 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 22.9 t -88.4 170.94 10.5 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.833 0.853 . . . . 0.0 111.932 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.4 t -152.49 160.01 43.28 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.636 1.175 . . . . 0.0 109.204 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.38 -173.49 46.22 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.351 -0.452 . . . . 0.0 112.643 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.51 160.22 26.06 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.584 0.754 . . . . 0.0 110.728 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.2 mt -139.12 162.65 34.43 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 125.265 1.426 . . . . 0.0 108.907 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -152.55 146.85 25.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 122.284 -0.26 . . . . 0.0 111.144 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.5 m-90 -122.72 171.81 8.89 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.788 1.235 . . . . 0.0 112.526 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -77.48 -7.77 56.72 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.915 0.486 . . . . 0.0 111.134 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 38.6 t -155.47 159.58 39.9 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.639 -0.663 . . . . 0.0 111.402 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.52 -34.19 73.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.818 0.447 . . . . 0.0 110.521 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 73.5 m -75.55 -23.83 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.093 0.157 . . . . 0.0 110.785 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -71.79 -35.93 70.15 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.69 -28.75 60.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.525 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.42 -38.77 55.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.697 0.399 . . . . 0.0 111.561 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -72.31 -36.2 68.84 Favored 'General case' 0 C--O 1.233 0.187 0 O-C-N 121.697 -0.627 . . . . 0.0 109.51 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.27 -20.48 63.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.9 -40.18 79.29 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 173.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.32 -39.35 95.86 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 119.792 -0.449 . . . . 0.0 111.984 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.26 6.6 m-85 -88.52 -16.41 32.73 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -115.01 -9.07 12.43 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -72.4 147.55 46.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.783 1.174 . . . . 0.0 109.588 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.445 ' CD2' HD22 ' A' ' 479' ' ' ASN . 1.9 t-80 57.24 17.53 3.67 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 37.0 t80 -70.1 138.75 52.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 178.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.98 133.74 41.63 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.076 -0.39 . . . . 0.0 111.875 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.6 mtm -83.68 152.43 24.75 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.626 0.371 . . . . 0.0 111.156 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -90.4 152.81 20.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -135.1 145.84 55.96 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.393 0.677 . . . . 0.0 109.917 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.62 -23.51 14.59 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 123.369 2.713 . . . . 0.0 112.599 -177.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -158.11 11.35 0.18 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.074 0.397 . . . . 0.0 111.574 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -71.27 148.05 43.5 Favored Glycine 0 CA--C 1.529 0.963 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.24 -24.76 16.46 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.523 2.815 . . . . 0.0 111.184 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.5 p90 -155.35 152.79 25.54 Favored Pre-proline 0 N--CA 1.454 -0.266 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 178.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -72.0 161.54 44.52 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.488 2.792 . . . . 0.0 111.297 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.89 142.38 50.67 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 102.545 -3.132 . . . . 0.0 102.545 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.256 0.7 OUTLIER -80.28 139.76 36.51 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.9 tt -84.47 152.17 24.14 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.414 1.085 . . . . 0.0 108.873 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.542 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -137.17 149.28 47.15 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 122.154 -0.341 . . . . 0.0 110.344 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.8 pp -153.95 162.63 41.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.106 0.479 . . . . 0.0 111.255 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 15.1 p -166.64 172.1 10.97 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.825 0.85 . . . . 0.0 110.75 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -56.14 127.23 29.63 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 33.2 t -81.97 148.89 28.45 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.259 1.0 OUTLIER -110.99 10.44 22.18 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 169.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.59 167.44 18.52 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.115 0.966 . . . . 0.0 111.491 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -93.99 -3.22 51.86 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -171.37 177.98 3.38 Favored 'General case' 0 C--N 1.338 0.101 0 C-N-CA 123.555 0.742 . . . . 0.0 110.16 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -134.92 21.33 3.51 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.812 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 178.137 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.43 " O3'" ' HE2' ' A' ' 415' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.504 1 O4'-C1'-N19 112.487 4.287 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C5'-C4'-C3' 110.21 -3.527 . 0.383 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.513 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.858 2 O4'-C1'-N19 113.02 4.82 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 1 C5'-C4'-C3' 108.485 -4.677 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 1 O4'-C1'-N19 113.728 5.528 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.527 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C5'-C4'-C3' 109.98 -3.68 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.858 0 C5'-C4'-C3' 110.686 -3.209 . 0.066 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.017 0 C3'-C2'-C1' 104.496 3.328 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.793 0 O4'-C1'-N19 111.3 3.1 . 0.219 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.823 1 C5'-C4'-C3' 108.082 -4.945 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.276 55.1 m-85 . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -74.09 170.73 53.05 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 111.53 -0.628 . . . . 0.0 111.53 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -69.85 165.31 31.49 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 124.135 3.223 . . . . 0.0 111.005 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -154.85 158.9 40.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.94 165.11 23.85 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.074 0.55 . . . . 0.0 111.346 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -75.48 -7.28 53.72 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.9 t -157.65 147.95 15.81 Favored Pre-proline 0 CA--C 1.531 0.219 0 O-C-N 122.149 -0.345 . . . . 0.0 111.196 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.39 -13.81 22.22 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 124.028 3.152 . . . . 0.0 111.909 172.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.4 t -100.38 151.47 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.558 0.743 . . . . 0.0 112.785 -177.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -130.7 153.75 48.66 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.396 1.478 . . . . 0.0 108.32 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -137.9 128.59 26.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.108 0.413 . . . . 0.0 111.018 -175.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.86 153.57 27.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.449 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.0 m-85 -142.56 173.5 11.48 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.33 9.72 78.93 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.22 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.2 mt -77.29 28.27 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.463 0.705 . . . . 0.0 111.849 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.65 -27.65 68.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . 0.425 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -77.83 149.96 34.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 121.288 0.566 . . . . 0.0 111.16 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 48.2 t -68.46 -14.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.309 0.643 . . . . 0.0 112.635 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.3 -17.32 63.72 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 46.5 mmm -85.75 148.2 25.97 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 118.53 0.604 . . . . 0.0 110.866 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.79 158.71 28.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.378 0.671 . . . . 0.0 109.259 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 99.5 m -54.3 -40.6 68.06 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 122.322 0.249 . . . . 0.0 110.809 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.69 -38.69 77.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -75.95 -46.0 32.08 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.26 -40.64 80.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.417 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 2.4 t80 -76.15 -31.25 58.47 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -170.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -76.97 -28.44 55.14 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.714 1.143 . . . . 0.0 110.227 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.1 t -58.24 -57.79 9.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.566 1.7 p90 -76.56 -4.92 45.39 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 118.175 2.658 . . . . 0.0 118.175 173.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.85 -35.01 64.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.764 -0.585 . . . . 0.0 111.24 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.92 -12.41 11.1 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -87.92 -8.99 54.99 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 117.21 2.3 . . . . 0.0 117.21 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 176.87 -148.71 9.12 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.434 0.561 . . . . 0.0 112.733 -176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -107.12 130.43 54.69 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.102 0.561 . . . . 0.0 110.49 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.417 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.1 m -114.11 165.57 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -177.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -129.06 -53.71 1.2 Allowed 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -152.11 165.38 34.94 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.195 0.907 . . . . 0.0 113.045 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.87 147.04 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 124.6 1.16 . . . . 0.0 109.085 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -152.26 116.23 4.89 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.125 0.57 . . . . 0.0 111.376 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.86 158.08 29.6 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 115.821 1.786 . . . . 0.0 115.821 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -114.8 120.95 41.77 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.842 0.457 . . . . 0.0 112.123 -176.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -79.31 -13.06 59.89 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.9 0.48 . . . . 0.0 111.475 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 96.0 p -82.34 1.44 37.06 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.251 0.62 . . . . 0.0 111.895 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.423 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.4 mmtm -139.81 157.15 70.3 Favored Pre-proline 0 C--N 1.34 0.153 0 C-N-CA 124.311 1.044 . . . . 0.0 109.306 -177.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -68.08 -16.91 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.97 2.446 . . . . 0.0 111.343 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.79 100.65 0.14 Allowed Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.58 158.86 34.72 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.531 0.733 . . . . 0.0 109.633 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -159.64 148.29 17.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.109 0.481 . . . . 0.0 112.078 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.4 mtp -94.34 154.53 17.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.14 0.976 . . . . 0.0 108.99 170.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -145.38 151.43 15.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -134.33 135.64 42.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 8.0 ptp -166.04 174.61 9.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.611 0.764 . . . . 0.0 110.138 -173.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.84 120.47 11.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -72.39 -33.39 67.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -168.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.76 -86.61 0.02 OUTLIER Glycine 0 C--N 1.335 0.495 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -71.59 -30.89 66.34 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -85.37 -36.4 20.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 119.259 -0.976 . . . . 0.0 112.403 -174.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -84.45 -28.3 6.95 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 C-N-CA 118.808 -1.157 . . . . 0.0 110.049 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.86 -46.7 67.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.79 175.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -39.03 89.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.246 -0.284 . . . . 0.0 110.941 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.43 91.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.795 -0.566 . . . . 0.0 110.29 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 59.9 mt -78.47 -8.77 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.283 0.633 . . . . 0.0 111.209 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 54.4 m -102.22 -18.22 15.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -127.48 -29.56 2.67 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -169.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 89.4 mt -134.67 -11.08 2.38 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.467 1.485 . . . . 0.0 114.368 -172.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.546 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.71 101.0 2.45 Favored 'General case' 0 C--O 1.205 -1.272 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -168.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.593 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 14.8 m-80 76.88 21.72 1.15 Allowed 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 123.333 2.788 . . . . 0.0 113.741 -161.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.07 162.23 17.7 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.258 58.0 m-85 -76.96 138.68 39.81 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -158.74 137.46 11.09 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.448 0.699 . . . . 0.0 109.484 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.1 m-85 57.23 25.34 10.93 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 117.266 2.321 . . . . 0.0 117.266 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.3 9.59 86.88 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 -177.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -135.81 -164.16 1.5 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.057 1.343 . . . . 0.0 108.52 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -129.06 146.65 50.97 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.108 -0.37 . . . . 0.0 111.281 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptm -118.96 75.14 1.01 Allowed 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.947 0.899 . . . . 0.0 109.442 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.593 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.4 m120 -53.0 125.23 16.53 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 116.272 -1.823 . . . . 0.0 112.192 -173.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.424 2.0 t -128.74 150.6 34.55 Favored 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 113.455 -3.298 . . . . 0.0 116.434 169.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.1 t -159.61 172.25 18.14 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.212 1.405 . . . . 0.0 107.807 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.5 p -72.3 147.28 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 18.9 t -82.51 156.65 23.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.414 ' HE3' ' C6 ' ' B' ' 2' ' ' ' C' . 17.3 ptpt -96.6 -12.4 24.01 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.001 0.121 . . . . 0.0 110.954 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -83.75 153.45 64.33 Favored Pre-proline 0 N--CA 1.454 -0.252 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.03 -34.52 2.18 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.335 2.69 . . . . 0.0 112.306 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.52 159.04 11.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.177 0.444 . . . . 0.0 111.695 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 87.7 mt -83.72 150.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 173.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 62.0 mtm -125.5 130.24 24.16 Favored Pre-proline 0 CA--C 1.53 0.178 0 O-C-N 122.312 -0.243 . . . . 0.0 111.213 173.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.7 165.36 26.95 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.933 3.089 . . . . 0.0 110.87 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 147.62 -108.73 0.44 Allowed Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 177.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -72.51 162.43 29.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 120.837 0.351 . . . . 0.0 110.278 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.9 p -161.27 177.04 10.57 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.914 0.486 . . . . 0.0 110.321 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -144.46 163.44 33.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.96 162.62 54.39 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 121.11 0.283 . . . . 0.0 113.077 -174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.88 171.27 10.86 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.017 0.927 . . . . 0.0 109.94 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -69.33 -26.89 64.93 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.293 -0.254 . . . . 0.0 111.061 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -120.17 11.7 11.67 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.34 -171.6 28.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.801 -0.52 . . . . 0.0 111.801 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 70.2 m -124.91 -7.91 7.23 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -177.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.2 t -127.07 138.95 53.3 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 85.3 p -85.31 9.1 16.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.874 0.87 . . . . 0.0 111.627 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -138.24 151.61 47.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.09 146.51 25.58 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.691 0.396 . . . . 0.0 110.1 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -112.25 139.98 47.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -126.0 4.59 7.24 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 45.7 t -65.81 -20.64 66.32 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.915 0.486 . . . . 0.0 111.499 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -113.86 1.48 14.78 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.51 . . . . 0.0 111.423 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 42.3 t -77.67 147.28 35.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.894 0.378 . . . . 0.0 111.334 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.21 -8.32 48.86 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.816 0.447 . . . . 0.0 110.926 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -61.88 -20.03 63.29 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 122.76 0.424 . . . . 0.0 112.052 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -58.74 115.36 3.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.235 0.614 . . . . 0.0 109.627 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -74.78 -33.43 62.26 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -172.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -95.25 16.04 17.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.3 p -70.99 -10.9 60.55 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.4 149.94 67.08 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.94 -25.32 59.7 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.989 2.459 . . . . 0.0 111.614 176.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -75.49 -28.31 59.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.363 0.265 . . . . 0.0 110.698 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -81.97 -46.11 14.45 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.96 -16.97 61.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -78.19 -19.77 53.23 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.443 0.297 . . . . 0.0 111.785 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.04 -2.93 8.13 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.12 159.64 22.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.498 0.59 . . . . 0.0 110.317 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -151.79 145.94 25.35 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.3 mm -140.53 139.83 34.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.747 0.819 . . . . 0.0 109.356 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -150.11 166.38 29.96 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.179 0.991 . . . . 0.0 109.661 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.51 138.84 97.48 Favored Pre-proline 0 C--O 1.233 0.203 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.36 151.07 81.91 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.463 2.775 . . . . 0.0 111.339 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 83.1 p -148.42 -173.73 4.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.303 -175.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -83.74 4.72 27.61 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.813 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.15 137.97 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 73.3 mt -124.5 155.58 38.72 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.989 0.515 . . . . 0.0 109.782 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -121.75 144.44 48.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.352 1.061 . . . . 0.0 108.265 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -136.65 159.25 42.38 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.457 0.646 . . . . 0.0 110.688 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -152.27 168.45 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 103.722 -2.695 . . . . 0.0 103.722 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 57.61 57.49 4.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.678 0.391 . . . . 0.0 111.486 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -142.23 119.46 7.25 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 122.392 -0.193 . . . . 0.0 111.176 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.04 161.75 3.18 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 124.417 3.411 . . . . 0.0 113.219 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.52 -16.41 63.87 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.275 0.63 . . . . 0.0 111.914 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -94.07 -1.99 53.54 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.5 m -78.93 -11.5 13.15 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.499 ' O ' ' N ' ' A' ' 512' ' ' GLU . 1.9 m -55.25 179.07 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.226 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -168.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.455 ' H ' HG23 ' A' ' 510' ' ' THR . 89.0 tt0 12.09 -68.8 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.851 2.061 . . . . 0.0 114.189 175.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 510' ' ' THR . 95.8 mt-10 -54.36 -48.14 71.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -88.0 -23.57 23.77 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 121.941 2.155 . . . . 0.0 106.014 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -62.13 -40.8 97.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 118.259 -1.376 . . . . 0.0 113.468 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -72.61 -44.07 62.46 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -77.38 -18.9 56.93 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.491 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.5 mt -75.51 -39.16 40.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.116 0 CA-C-N 118.486 0.585 . . . . 0.0 109.509 173.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.8 -38.69 89.64 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.769 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -68.7 -29.36 67.78 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -75.08 -26.52 59.39 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.392 0.277 . . . . 0.0 110.775 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.72 -2.16 44.99 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 111.326 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.86 -0.7 61.22 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 123.295 0.474 . . . . 0.0 113.104 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.0 151.16 5.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.893 0.847 . . . . 0.0 112.206 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.42 149.84 49.72 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.937 0.398 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.94 152.92 91.02 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 123.112 0.565 . . . . 0.0 111.226 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.57 157.59 60.21 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.631 2.887 . . . . 0.0 110.529 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -89.22 -17.14 29.66 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.7 t -155.21 159.13 39.87 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.613 0.244 . . . . 0.0 111.421 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 62.6 t -143.13 144.93 23.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 C-N-CA 124.449 1.1 . . . . 0.0 110.09 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -148.18 140.97 24.66 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.18 143.74 29.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -154.89 -171.77 3.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.8 t -141.44 -172.15 3.46 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.765 0.826 . . . . 0.0 109.91 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 100.46 11.22 42.19 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 123.526 0.584 . . . . 0.0 112.373 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -126.95 -17.32 4.91 Favored 'General case' 0 C--N 1.339 0.148 0 CA-C-N 117.762 0.781 . . . . 0.0 112.593 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -163.56 152.96 14.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 117.876 0.307 . . . . 0.0 110.774 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.93 -8.09 31.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.921 0.489 . . . . 0.0 110.63 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -79.38 -41.85 26.86 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.254 0.622 . . . . 0.0 111.684 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.5 p -164.05 173.59 12.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 110.814 -173.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 45.5 p -83.44 177.74 8.33 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.547 0.689 . . . . 0.0 111.066 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.6 p -150.57 163.06 39.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.75 -169.67 42.65 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.827 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.33 160.28 23.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.448 0.699 . . . . 0.0 110.479 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.9 mt -139.27 157.96 44.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.858 1.263 . . . . 0.0 108.091 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -148.12 149.23 31.65 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.093 0.406 . . . . 0.0 111.995 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -127.12 175.06 8.41 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.351 1.461 . . . . 0.0 112.39 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -76.52 -12.3 60.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.609 0.364 . . . . 0.0 110.999 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.5 t -158.32 160.52 37.08 Favored 'General case' 0 C--O 1.232 0.163 0 O-C-N 121.808 -0.557 . . . . 0.0 110.851 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -75.15 -21.54 58.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.02 -0.425 . . . . 0.0 110.935 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.4 m -77.25 -25.67 51.73 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.019 0.372 . . . . 0.0 110.065 174.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -74.72 -34.05 62.51 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.245 0.618 . . . . 0.0 111.896 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.35 -28.96 57.03 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.386 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.5 tp -72.74 -39.25 67.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.734 0.243 . . . . 0.0 111.284 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -73.39 -39.03 65.41 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -26.27 62.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 176.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -68.11 -37.73 81.49 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 172.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.94 -30.05 75.51 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.559 -0.578 . . . . 0.0 112.325 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 7.5 m-85 -98.69 -8.25 26.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 118.924 2.935 . . . . 0.0 118.924 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.36 -8.69 10.51 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -72.05 145.36 48.31 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.354 0.979 . . . . 0.0 108.923 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.64 21.84 9.2 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.571 0.748 . . . . 0.0 112.326 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -61.54 134.24 56.62 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -81.11 121.21 25.82 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.047 -0.408 . . . . 0.0 110.732 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.8 152.61 18.33 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -67.27 162.36 22.9 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 169.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -151.09 121.34 3.68 Favored Pre-proline 0 CA--C 1.531 0.25 0 O-C-N 122.342 -0.224 . . . . 0.0 110.639 -178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -79.77 -16.05 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.284 2.656 . . . . 0.0 111.886 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -82.87 -12.45 57.39 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 173.11 173.76 39.72 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -71.6 -19.59 27.91 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.904 3.07 . . . . 0.0 111.5 -177.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -78.65 130.54 70.57 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.51 168.85 14.28 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.689 2.926 . . . . 0.0 111.486 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -129.82 142.37 50.69 Favored 'General case' 0 N--CA 1.457 -0.109 0 N-CA-C 103.049 -2.945 . . . . 0.0 103.049 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.251 1.0 OUTLIER -81.67 131.3 35.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -178.053 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -78.5 149.29 33.17 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.542 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -137.03 147.25 46.09 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.566 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.92 159.84 38.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.647 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 20.4 p -160.81 174.74 13.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.024 0.929 . . . . 0.0 110.144 -177.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -58.09 124.45 19.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.431 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 29.3 t -79.76 149.52 31.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -171.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.266 0.8 OUTLIER -111.38 9.97 21.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 169.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.82 164.42 19.66 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.231 1.012 . . . . 0.0 111.863 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -92.83 -3.07 55.3 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.709 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -170.6 177.0 4.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.746 0.818 . . . . 0.0 110.074 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.41 28.33 1.2 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.072 0.549 . . . . 0.0 111.64 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 117.426 -1.273 . . . . 0.0 111.154 -177.797 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.449 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.683 1 O4'-C1'-N19 112.487 4.287 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . 0.414 ' C6 ' ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C5'-C4'-C3' 110.767 -3.155 . 0.447 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 1 C3'-C2'-C1' 105.378 4.309 . 0.126 0b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 1 C5'-C4'-C3' 108.957 -4.362 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.814 1 O4'-C1'-N19 113.185 4.985 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.443 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C3'-C2'-C1' 104.625 3.473 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.778 0 O4'-C1'-N19 111.235 3.035 . 0.077 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.939 0 C3'-C2'-C1' 104.871 3.745 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.431 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.92 0 O4'-C1'-N19 111.066 2.866 . 0.177 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 1 C5'-C4'-C3' 108.315 -4.79 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.26 7.8 p90 . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -75.63 -176.6 40.02 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 111.959 -0.456 . . . . 0.0 111.959 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.4 170.09 1.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.774 3.65 . . . . 0.0 112.821 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -148.59 152.3 36.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.915 0.486 . . . . 0.0 110.728 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.72 26.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.066 0.547 . . . . 0.0 110.882 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -82.81 -0.93 50.23 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.1 t -156.96 144.77 14.08 Favored Pre-proline 0 C--O 1.232 0.151 0 C-N-CA 122.804 0.442 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.7 -15.29 33.56 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.209 2.606 . . . . 0.0 110.836 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.01 150.91 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.1 153.03 42.49 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.933 0.893 . . . . 0.0 109.707 -175.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 97.0 mmm -120.32 147.59 44.82 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 123.55 0.74 . . . . 0.0 111.39 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 5.9 p -139.65 146.2 25.67 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -143.21 173.71 11.35 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . 0.429 ' C ' ' H ' ' A' ' 387' ' ' ASP . . . 89.18 13.56 61.75 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.673 -0.571 . . . . 0.0 111.673 -179.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 20.7 mt -75.73 32.32 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.881 0.872 . . . . 0.0 111.481 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 385' ' ' GLY . 61.3 m-20 -71.08 14.29 0.16 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -137.12 149.57 47.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.126 0.571 . . . . 0.0 110.811 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 39.3 t -69.53 -13.63 62.43 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.495 0.718 . . . . 0.0 112.057 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -67.77 -20.61 65.24 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 122.676 0.39 . . . . 0.0 111.875 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 67.4 mtp -94.28 148.57 22.08 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.069 -0.394 . . . . 0.0 110.615 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.78 154.39 28.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.3 p -59.17 -30.69 68.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -176.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -70.09 -43.23 71.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -76.03 -42.1 48.84 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 41.4 t -69.32 -42.31 81.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -76.29 -29.99 57.59 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.805 -0.616 . . . . 0.0 111.19 -171.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -75.95 -31.04 58.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.344 0.975 . . . . 0.0 109.857 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.97 -55.63 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.55 1.8 p90 -76.59 -4.86 45.12 Favored 'General case' 0 C--N 1.339 0.147 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . 0.511 ' HG ' ' CG1' ' A' ' 406' ' ' VAL . 41.8 t -72.39 -34.31 67.82 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 122.008 -0.432 . . . . 0.0 110.867 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.52 -14.46 19.88 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.096 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.33 -3.48 58.46 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.6 -174.83 43.29 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 119.193 0.906 . . . . 0.0 113.262 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -76.34 130.12 37.62 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.511 ' CG1' ' HG ' ' A' ' 401' ' ' CYS . 1.2 m -114.11 165.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -129.93 -61.3 1.0 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 176.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -148.39 165.13 32.02 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -170.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.37 145.01 21.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 124.774 1.23 . . . . 0.0 108.485 171.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -153.7 121.49 5.98 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -76.98 166.93 22.66 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.8 ptp -142.82 138.0 30.04 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 118.879 0.763 . . . . 0.0 112.714 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -5.56 53.98 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.706 1.202 . . . . 0.0 112.156 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.0 t -78.06 -4.97 49.9 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.214 0.605 . . . . 0.0 111.646 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.49 155.57 67.15 Favored Pre-proline 0 CA--C 1.53 0.184 0 C-N-CA 123.993 0.917 . . . . 0.0 109.918 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 -13.75 38.14 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.392 2.728 . . . . 0.0 111.894 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.43 87.27 0.07 OUTLIER Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -152.48 160.44 43.25 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.963 0.505 . . . . 0.0 110.838 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.61 170.43 22.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.663 0.385 . . . . 0.0 110.434 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 22.1 mtm -123.97 157.34 34.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.034 0.934 . . . . 0.0 108.828 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -142.0 152.03 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.756 0.822 . . . . 0.0 110.38 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.73 132.87 42.78 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtp -155.13 172.39 18.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -171.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.08 127.05 30.6 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 170.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -73.07 -34.76 66.43 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -168.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.11 -89.1 0.01 OUTLIER Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -72.78 -26.54 61.57 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.7 -36.43 17.4 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 118.838 -1.145 . . . . 0.0 111.668 -174.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.79 -27.31 6.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.205 0 C-N-CA 118.553 -1.259 . . . . 0.0 109.374 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -68.77 -53.39 22.05 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.108 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 25.6 mtm180 -68.9 -29.99 68.39 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.05 78.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.094 -0.643 . . . . 0.0 110.011 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.72 -9.97 12.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.303 0.641 . . . . 0.0 111.084 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 29.9 m -96.77 -21.33 17.61 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -125.79 -26.9 3.41 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -169.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 88.1 mt -134.59 -8.75 2.48 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.906 1.684 . . . . 0.0 114.624 -172.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.567 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.2 p-10 -71.63 101.09 2.43 Favored 'General case' 0 C--O 1.207 -1.157 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -168.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.565 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 16.3 m-80 77.47 22.02 0.97 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 123.98 3.082 . . . . 0.0 114.054 -160.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -76.87 163.06 27.12 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.906 -1.121 . . . . 0.0 110.207 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -68.71 136.61 53.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 173.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.9 ttt -158.43 142.26 15.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.478 ' CE1' ' HG3' ' A' ' 554' ' ' GLU 0.273 53.2 m-85 59.92 15.63 5.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.16 9.17 70.74 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -136.03 -171.14 2.8 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.497 1.119 . . . . 0.0 108.439 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -128.43 136.2 50.54 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.088 -0.383 . . . . 0.0 110.795 178.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -94.82 -152.51 0.36 Allowed 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.565 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 31.4 t-20 -159.22 129.28 5.69 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 115.903 -1.999 . . . . 0.0 110.521 175.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.567 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.459 2.1 t -124.03 145.25 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 112.864 -3.534 . . . . 0.0 115.147 167.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -161.29 164.76 29.99 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.869 0.868 . . . . 0.0 109.442 -176.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.4 p -75.29 150.69 6.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 37.0 t -93.29 158.09 15.92 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.726 0.81 . . . . 0.0 111.997 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -96.85 -7.88 32.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.667 0.387 . . . . 0.0 110.552 175.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -71.01 147.52 93.9 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.494 0.717 . . . . 0.0 110.526 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.9 -32.91 2.39 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.195 2.597 . . . . 0.0 111.435 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.77 158.87 9.34 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.544 0.738 . . . . 0.0 110.395 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 67.5 mt -82.89 133.42 29.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 34.2 mmm -98.0 129.32 31.3 Favored Pre-proline 0 N--CA 1.454 -0.274 0 C-N-CA 122.374 0.27 . . . . 0.0 111.241 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.32 161.95 37.04 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.437 2.758 . . . . 0.0 109.024 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 151.76 -129.52 2.85 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 121.128 -0.558 . . . . 0.0 111.899 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -72.32 171.3 12.43 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.267 0.627 . . . . 0.0 111.149 -177.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.6 p -156.01 170.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.538 0.735 . . . . 0.0 109.403 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -128.75 5.88 5.55 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.39 -170.95 55.16 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.215 -0.303 . . . . 0.0 112.499 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.3 mt -143.01 168.35 19.91 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.081 0.952 . . . . 0.0 109.592 -178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -75.22 -24.34 57.71 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 122.364 -0.21 . . . . 0.0 110.45 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -120.61 20.27 11.8 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.618 0.767 . . . . 0.0 110.825 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.33 167.32 36.86 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.604 -0.685 . . . . 0.0 112.289 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 t -93.66 -26.67 16.95 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.73 0.412 . . . . 0.0 112.111 -176.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.7 t -127.02 148.03 50.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.986 0.515 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.4 p -90.17 7.94 35.48 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.394 0.678 . . . . 0.0 111.418 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -134.34 145.82 49.37 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -156.57 151.73 26.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.888 0.375 . . . . 0.0 110.663 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.1 130.32 41.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.587 0.755 . . . . 0.0 112.25 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.54 -12.03 41.12 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 117.542 2.423 . . . . 0.0 117.542 -173.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 43.9 t -68.93 -29.93 68.27 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.641 0.257 . . . . 0.0 110.357 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -80.0 -18.38 50.4 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.699 0.399 . . . . 0.0 111.117 177.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.2 m -93.87 -4.0 50.78 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.873 0.469 . . . . 0.0 112.056 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.66 3.96 0.96 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.311 1.044 . . . . 0.0 112.83 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -59.61 -17.64 34.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -57.05 122.27 11.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.247 0.619 . . . . 0.0 110.625 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -81.05 -33.66 33.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.304 64.7 m-85 -98.0 10.46 40.29 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 117.376 2.362 . . . . 0.0 117.376 -178.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 86.5 p -71.79 -10.72 60.19 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' THR . . . . . 0.42 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -135.96 148.98 67.19 Favored Pre-proline 0 C--O 1.232 0.136 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 179.623 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.47 -24.63 63.64 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 123.237 2.625 . . . . 0.0 111.554 176.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -73.97 -27.5 61.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.344 0.257 . . . . 0.0 110.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -88.44 -43.17 11.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 175.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.39 63.79 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.48 -18.61 44.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -124.06 -4.9 7.94 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -62.93 158.97 17.85 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.105 0.411 . . . . 0.0 110.752 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.428 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 13.0 ptp180 -150.03 144.91 26.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.5 mm -136.29 153.03 30.69 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 C-N-CA 123.891 0.876 . . . . 0.0 108.724 -175.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -155.01 162.26 41.13 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -57.28 153.01 28.54 Favored Pre-proline 0 CA--C 1.531 0.225 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -63.81 143.41 86.06 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.923 2.416 . . . . 0.0 109.644 -177.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.4 t -153.63 171.93 18.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.774 0.43 . . . . 0.0 110.205 -173.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -83.73 2.31 38.48 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.265 -0.272 . . . . 0.0 110.877 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.39 137.81 24.82 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 71.0 mt -125.39 156.09 39.34 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.081 0.553 . . . . 0.0 109.691 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -125.09 132.79 53.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -120.96 160.59 23.21 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 111.505 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -147.79 153.6 39.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 28.0 m120 55.52 57.47 5.32 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.072 -175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -113.6 153.06 45.9 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 122.897 0.479 . . . . 0.0 110.205 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -57.7 153.63 41.84 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.493 2.795 . . . . 0.0 112.696 -177.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.65 -16.3 63.79 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.381 0.672 . . . . 0.0 112.059 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -122.95 25.0 8.77 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.484 0.714 . . . . 0.0 110.95 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.61 -9.35 10.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 512' ' ' GLU . 0.2 OUTLIER -54.88 -177.29 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 117.214 -1.374 . . . . 0.0 114.222 -165.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.508 ' H ' HG21 ' A' ' 510' ' ' THR . 8.8 pm0 -30.86 -33.55 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.397 1.453 . . . . 0.0 114.77 -167.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.0 mt-10 -60.3 -45.64 92.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 117.047 -1.454 . . . . 0.0 114.723 170.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -87.53 -30.03 20.89 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 122.745 2.52 . . . . 0.0 106.528 -173.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -62.44 -33.81 75.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -76.15 -42.71 45.8 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -79.84 -19.27 48.77 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.659 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.2 -44.87 42.75 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 118.698 0.681 . . . . 0.0 110.081 175.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.6 m -64.19 -33.93 76.91 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.902 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -67.28 -37.39 83.35 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.013 0.435 . . . . 0.0 112.01 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -74.46 -30.71 61.98 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.707 0.403 . . . . 0.0 111.124 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.35 -4.61 58.99 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.649 0.379 . . . . 0.0 111.926 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 71.95 33.6 62.58 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.62 159.63 42.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.57 0.748 . . . . 0.0 112.889 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.08 149.09 50.83 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.138 0.575 . . . . 0.0 111.736 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -91.13 157.13 43.33 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.572 0.749 . . . . 0.0 111.023 -178.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -68.23 160.83 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.575 2.85 . . . . 0.0 111.196 174.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -97.87 -18.6 18.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 38.1 m -148.49 156.34 42.33 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.671 . . . . 0.0 110.959 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 59.7 t -143.98 148.22 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.543 0.737 . . . . 0.0 110.863 -175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -147.35 142.36 27.02 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 123.804 0.842 . . . . 0.0 108.884 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -140.51 142.82 30.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 122.99 0.516 . . . . 0.0 112.282 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -156.09 -175.61 5.52 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -178.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.2 p -142.71 -169.09 2.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.465 1.106 . . . . 0.0 109.336 178.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.43 8.85 62.25 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.698 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . 0.578 ' HZ3' ' HB3' ' A' ' 535' ' ' LYS . 0.4 OUTLIER -140.02 9.62 2.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 117.699 0.749 . . . . 0.0 111.371 179.022 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 42.5 t -158.63 157.62 32.24 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.765 0.826 . . . . 0.0 109.543 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -116.96 -5.34 11.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.996 0.518 . . . . 0.0 111.037 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -89.91 -50.17 6.19 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 122.843 0.457 . . . . 0.0 112.205 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 80.6 p -165.53 179.0 6.35 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 122.77 0.428 . . . . 0.0 110.94 -177.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 74.3 m -70.22 168.95 14.69 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.8 t -147.07 163.96 34.58 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.58 1.552 . . . . 0.0 108.398 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.12 -171.92 44.92 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.126 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.82 160.31 22.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.8 0.84 . . . . 0.0 110.484 -177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.3 mt -140.66 158.16 44.38 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.647 1.179 . . . . 0.0 108.936 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -148.72 152.21 36.23 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 117.607 0.185 . . . . 0.0 111.228 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.4 m-90 -128.42 167.84 16.45 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.869 1.268 . . . . 0.0 112.785 -177.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -70.53 -8.32 50.42 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -158.44 161.22 37.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.51 0.324 . . . . 0.0 110.932 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -66.13 -34.83 78.94 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.906 0.482 . . . . 0.0 110.219 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.9 p -78.35 -25.82 46.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.425 0.29 . . . . 0.0 110.893 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -68.79 -35.34 76.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.39 65.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 48.0 tp -65.51 -40.06 92.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.613 0.244 . . . . 0.0 110.585 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . 0.478 ' HG3' ' CE1' ' A' ' 442' ' ' PHE . 39.8 tt0 -64.27 -47.93 77.67 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.479 0.657 . . . . 0.0 110.712 177.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.86 -19.2 61.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.62 -44.29 82.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 173.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.9 -45.69 96.03 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.284 19.0 m-85 -76.86 -32.02 57.22 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 119.103 3.001 . . . . 0.0 119.103 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 57.8 mt -90.73 -19.29 23.71 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 119.504 1.047 . . . . 0.0 112.933 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -73.99 145.34 44.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.131 0.878 . . . . 0.0 110.118 -178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 57.54 12.62 1.58 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.431 1.093 . . . . 0.0 113.091 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 40.1 t80 -72.9 138.83 46.45 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -71.73 132.83 45.08 Favored 'General case' 0 N--CA 1.457 -0.114 0 O-C-N 122.212 -0.305 . . . . 0.0 111.706 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.1 mtm -83.73 152.56 24.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.59 0.356 . . . . 0.0 110.96 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.22 146.84 45.19 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -155.85 78.02 4.49 Favored Pre-proline 0 N--CA 1.454 -0.244 0 O-C-N 122.165 -0.335 . . . . 0.0 110.669 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -71.0 -8.6 23.97 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.214 2.609 . . . . 0.0 111.029 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -93.83 5.82 50.41 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.407 0.683 . . . . 0.0 112.366 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -154.31 168.05 32.51 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-N 118.316 0.507 . . . . 0.0 112.033 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.03 -18.03 21.7 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 124.26 3.307 . . . . 0.0 112.48 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -150.57 151.03 30.0 Favored Pre-proline 0 N--CA 1.455 -0.202 0 N-CA-C 116.232 1.938 . . . . 0.0 116.232 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.77 164.46 33.56 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.806 3.004 . . . . 0.0 111.746 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -129.98 142.35 50.64 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 103.047 -2.945 . . . . 0.0 103.047 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -76.65 142.21 40.7 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.864 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.1 tt -83.88 150.32 25.79 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.196 0.998 . . . . 0.0 108.457 173.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -134.0 151.38 51.42 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 118.475 0.58 . . . . 0.0 111.147 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.4 pp -159.46 167.69 28.07 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.104 0.478 . . . . 0.0 111.43 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 12.5 p -162.6 174.05 13.13 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.293 1.037 . . . . 0.0 110.409 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -57.36 121.38 10.05 Favored 'General case' 0 C--N 1.34 0.156 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.426 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 38.9 t -77.83 149.15 34.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 0.6 OUTLIER -110.98 9.93 22.19 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 114.7 1.371 . . . . 0.0 114.7 169.545 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.22 166.57 16.06 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.161 0.984 . . . . 0.0 111.84 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -93.32 -3.03 54.21 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.84 177.97 3.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.575 0.75 . . . . 0.0 110.04 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -144.62 31.8 1.18 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.762 0.425 . . . . 0.0 111.607 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.89 -178.864 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.7 1 O4'-C1'-N19 112.453 4.253 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 O4'-C1'-N19 111.506 3.306 . 0.414 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.982 0 C3'-C2'-C1' 105.087 3.985 . 0.132 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.706 1 C5'-C4'-C3' 109.182 -4.212 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 1 O4'-C1'-N19 113.784 5.584 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.478 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C5'-C4'-C3' 110.024 -3.651 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.857 0 C5'-C4'-C3' 111.22 -2.853 . 0.075 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 C3'-C2'-C1' 104.647 3.496 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.428 ' C6 ' ' HD2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.418 -2.888 0 O4'-C1'-N19 111.271 3.071 . 0.223 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.929 1 C5'-C4'-C3' 107.651 -5.233 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.256 54.1 m-85 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 115.108 1.522 . . . . 0.0 115.108 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -72.82 176.57 42.91 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.38 174.85 9.44 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.274 3.316 . . . . 0.0 110.719 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -147.89 154.59 40.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 120.868 0.366 . . . . 0.0 110.815 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.43 161.14 30.1 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.151 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -75.44 -5.71 46.42 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.2 t -158.71 146.7 13.68 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 122.895 0.478 . . . . 0.0 110.553 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.21 -16.79 40.12 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.288 2.659 . . . . 0.0 110.519 174.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.57 148.77 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.7 tt -137.6 152.0 48.93 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.771 1.229 . . . . 0.0 107.966 -178.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.1 tpt -134.59 130.11 35.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.397 0.142 . . . . 0.0 110.779 -172.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.68 152.85 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.45 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.8 m-85 -139.91 172.16 13.17 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 104.624 -2.361 . . . . 0.0 104.624 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.84 9.42 77.8 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 120.141 -0.255 . . . . 0.0 112.653 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.8 mt -79.02 27.89 0.23 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.553 0.676 . . . . 0.0 112.244 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.81 -41.46 95.77 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.0 pm0 -67.04 146.22 54.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.051 0.453 . . . . 0.0 111.016 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 56.6 m -68.68 -10.12 54.34 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -173.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -73.17 -19.62 61.08 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 117.939 0.336 . . . . 0.0 111.612 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 86.8 mmm -82.32 146.65 29.29 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.157 0.435 . . . . 0.0 110.587 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -160.92 155.74 23.89 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -59.13 -36.79 75.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -176.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -68.23 -39.33 82.37 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -75.93 -47.51 24.9 Favored 'General case' 0 C--N 1.34 0.153 0 O-C-N 122.192 -0.318 . . . . 0.0 111.651 -173.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.38 -37.74 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.8 -31.84 57.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -75.94 -29.9 58.51 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.703 1.138 . . . . 0.0 110.296 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -60.13 -55.8 21.74 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 2.5 p90 -76.57 -3.93 40.18 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 117.505 2.409 . . . . 0.0 117.505 174.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . 0.42 ' HG ' HG13 ' A' ' 406' ' ' VAL . 40.6 t -74.95 -35.0 62.14 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.059 -0.401 . . . . 0.0 110.803 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.09 -15.83 26.66 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.13 -7.39 59.64 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 117.295 2.331 . . . . 0.0 117.295 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.64 -143.21 6.99 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 -176.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -113.77 132.94 55.66 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.801 0.44 . . . . 0.0 110.773 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.42 HG13 ' HG ' ' A' ' 401' ' ' CYS . 1.2 m -114.01 165.5 8.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -117.63 -67.42 0.99 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -154.45 170.51 21.21 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.73 148.48 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.066 0 C-N-CA 123.845 0.858 . . . . 0.0 109.42 -177.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -152.31 108.52 3.4 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 122.576 0.351 . . . . 0.0 111.415 -174.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -73.24 163.88 27.48 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 24.0 ptp -142.18 142.03 32.66 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -5.57 54.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.742 1.617 . . . . 0.0 112.987 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.6 t -77.87 -8.18 57.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.109 0.563 . . . . 0.0 112.238 -172.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.409 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 45.2 mmtm -141.03 157.52 66.89 Favored Pre-proline 0 CA--C 1.528 0.12 0 C-N-CA 123.644 0.777 . . . . 0.0 109.598 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -67.54 -12.23 34.92 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.181 2.588 . . . . 0.0 111.496 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.05 95.4 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.56 160.41 38.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.208 0.603 . . . . 0.0 110.05 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.03 153.95 23.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.22 0.533 . . . . 0.0 111.732 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 83.3 mtp -96.97 153.29 17.99 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.948 0.899 . . . . 0.0 108.985 172.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.8 t -145.51 153.83 13.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -139.07 134.29 32.75 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 30.3 mtp -151.86 173.31 14.94 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 123.757 0.823 . . . . 0.0 109.388 -170.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.31 125.07 23.92 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 169.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.93 -33.1 65.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -167.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.17 -89.33 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -73.74 -23.69 59.79 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.97 -32.56 15.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 118.737 -1.185 . . . . 0.0 112.107 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.2 -25.06 6.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 120.179 1.354 . . . . 0.0 109.082 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -68.53 -50.15 54.2 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 118.056 0.389 . . . . 0.0 111.302 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.64 -37.0 85.32 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.35 80.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.732 0.697 . . . . 0.0 110.674 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.2 mt -77.72 -12.76 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 123.028 0.531 . . . . 0.0 110.81 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.8 m -96.8 -18.96 19.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -129.5 -25.76 2.6 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 116.161 1.912 . . . . 0.0 116.161 -169.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -129.52 -14.32 4.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.144 1.338 . . . . 0.0 113.473 -172.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.578 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.94 100.91 2.55 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -168.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.552 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 10.1 m-80 76.69 21.27 1.28 Allowed 'General case' 0 N--CA 1.481 1.088 0 O-C-N 117.916 -2.99 . . . . 0.0 112.264 -162.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -84.03 157.45 21.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -77.51 139.37 39.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.6 ttt -159.12 138.61 11.55 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.022 0.529 . . . . 0.0 109.597 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.399 49.8 m-85 56.92 25.79 10.95 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 -178.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 77.95 10.33 86.3 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 111.501 -0.639 . . . . 0.0 111.501 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -134.83 -167.3 1.96 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.861 1.264 . . . . 0.0 108.913 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -132.29 147.81 52.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.285 0.234 . . . . 0.0 111.031 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 18.7 ptt? -125.36 87.23 2.67 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 176.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.552 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.0 m120 -55.45 128.35 33.92 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 115.634 -2.127 . . . . 0.0 111.907 -174.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.578 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.423 2.4 t -126.82 154.15 36.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.28 -3.368 . . . . 0.0 116.059 169.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 37.9 t -162.09 167.42 24.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.568 1.547 . . . . 0.0 107.757 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.93 147.91 10.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 26.2 t -79.44 165.18 23.33 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 122.52 0.328 . . . . 0.0 110.5 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.4 31.56 6.27 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -137.12 160.91 64.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 172.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -75.0 -37.1 2.18 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.986 2.457 . . . . 0.0 116.198 -167.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -166.01 154.5 11.06 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.946 1.248 . . . . 0.0 112.889 -176.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 66.0 mt -77.05 150.83 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 173.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 54.9 mtm -129.27 136.79 29.7 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 117.584 0.175 . . . . 0.0 111.319 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.78 168.75 23.65 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.085 3.19 . . . . 0.0 110.564 177.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 143.37 -115.04 0.88 Allowed Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -72.43 153.55 41.35 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.1 0.56 . . . . 0.0 110.454 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 46.9 m -152.96 172.56 16.62 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.135 0.974 . . . . 0.0 110.03 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -144.58 164.07 32.01 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -83.38 132.08 10.83 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.22 163.37 26.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 174.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.69 -18.52 64.95 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -120.55 23.11 10.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.102 0.561 . . . . 0.0 109.931 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.97 -162.31 15.75 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.691 -0.631 . . . . 0.0 112.351 -176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 98.2 p -133.1 -10.74 2.95 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 122.727 0.411 . . . . 0.0 112.001 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.1 t -127.09 155.9 42.55 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.912 0.485 . . . . 0.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 80.2 p -115.72 8.96 15.07 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.446 0.698 . . . . 0.0 111.794 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -135.5 146.29 47.96 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -155.37 157.65 37.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.468 0.175 . . . . 0.0 110.64 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -128.77 139.35 52.24 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -173.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -133.78 5.07 3.63 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 31.9 t -65.39 -22.69 66.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.266 0.627 . . . . 0.0 111.825 -174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -113.89 1.48 14.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.156 0.582 . . . . 0.0 111.479 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -79.66 153.33 29.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.526 0.33 . . . . 0.0 111.365 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -85.42 -7.51 58.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.509 0.324 . . . . 0.0 111.283 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . 0.451 HD22 ' CD2' ' A' ' 561' ' ' HIS . 5.6 m-20 -60.13 -20.74 59.81 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -60.5 127.61 32.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -70.11 -33.76 72.25 Favored 'General case' 0 N--CA 1.458 -0.066 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -170.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.363 55.8 m-85 -98.14 17.53 18.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.5 t -60.0 -28.57 67.83 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -172.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.56 155.32 75.37 Favored Pre-proline 0 C--N 1.339 0.129 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -178.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.27 -25.37 76.64 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.306 2.671 . . . . 0.0 112.066 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -74.65 -29.75 61.37 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -80.43 -45.42 17.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.78 66.12 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.6 -25.0 56.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.936 0.335 . . . . 0.0 111.609 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -124.02 3.84 8.67 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -61.19 154.7 22.64 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.425 0.557 . . . . 0.0 111.679 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.414 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 12.9 ptp180 -154.63 141.87 19.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.0 mm -137.22 148.66 26.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.648 0.779 . . . . 0.0 109.337 -174.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -148.52 170.03 18.96 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.512 0.725 . . . . 0.0 110.59 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -64.43 157.09 74.13 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.71 148.32 90.16 Favored 'Trans proline' 0 N--CA 1.448 -1.197 0 C-N-CA 122.524 2.15 . . . . 0.0 109.808 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.9 t -153.95 173.66 15.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.815 0.446 . . . . 0.0 109.839 -173.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -83.74 -3.18 57.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.279 -0.263 . . . . 0.0 110.732 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -96.95 138.22 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 176.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 65.6 mt -125.5 156.52 38.85 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.19 0.596 . . . . 0.0 109.862 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -124.53 143.42 50.68 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -132.96 160.13 37.98 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.977 0.418 . . . . 0.0 111.452 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -144.16 150.96 38.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 51.83 57.42 6.54 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.304 1.042 . . . . 0.0 112.587 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -104.14 156.33 35.89 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.512 0.725 . . . . 0.0 110.302 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.83 153.04 32.65 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.317 2.678 . . . . 0.0 112.742 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.67 -16.34 63.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.442 0.697 . . . . 0.0 112.047 -176.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -122.92 20.99 9.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.523 0.729 . . . . 0.0 110.949 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.74 -16.12 19.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.578 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.47 -177.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -165.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.578 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -22.72 -41.04 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -170.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.2 mt-10 -58.49 -47.53 83.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 117.268 -1.349 . . . . 0.0 114.358 172.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -87.0 -28.32 22.71 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 122.416 2.371 . . . . 0.0 106.776 -172.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -65.35 -37.57 87.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 119.22 -0.992 . . . . 0.0 113.599 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -75.98 -37.66 58.28 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -81.71 -22.16 37.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.491 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.1 mt -75.94 -41.46 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 CA-C-N 118.624 0.647 . . . . 0.0 110.065 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.0 m -67.88 -34.77 77.31 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.089 0.404 . . . . 0.0 111.092 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.51 -34.74 72.65 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -69.19 -25.13 64.18 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.494 0.317 . . . . 0.0 110.922 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.81 -5.18 35.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.332 0.653 . . . . 0.0 111.552 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.2 -3.86 43.96 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.473 0.559 . . . . 0.0 113.02 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.8 m -78.79 164.56 3.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 CA-C-N 117.777 0.789 . . . . 0.0 112.522 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -67.37 149.1 50.75 Favored 'General case' 0 C--N 1.338 0.088 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -84.17 149.06 54.78 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.889 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.33 150.0 70.28 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.127 2.551 . . . . 0.0 110.589 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -85.24 -18.18 34.77 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 35.7 m -150.51 155.44 39.49 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.41 0.684 . . . . 0.0 110.982 176.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 91.7 t -144.01 147.92 19.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 123.644 0.777 . . . . 0.0 110.072 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -149.71 141.75 23.91 Favored 'General case' 0 N--CA 1.457 -0.081 0 C-N-CA 123.311 0.644 . . . . 0.0 109.369 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.71 142.74 31.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 123.227 0.611 . . . . 0.0 112.089 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -155.94 -173.8 4.68 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 99.0 p -138.53 -171.08 2.97 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.276 1.031 . . . . 0.0 110.115 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.52 7.77 57.79 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 119.779 -0.456 . . . . 0.0 112.326 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -125.56 -14.03 6.41 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 117.594 0.697 . . . . 0.0 112.154 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 34.8 t -162.23 148.31 13.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.861 0.464 . . . . 0.0 110.502 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -97.76 -8.07 29.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.916 0.486 . . . . 0.0 110.614 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -85.03 -38.64 18.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.245 0.618 . . . . 0.0 112.116 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 3.6 m -161.82 165.41 27.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.938 0.495 . . . . 0.0 111.816 -172.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 66.2 m -80.04 170.21 16.78 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.612 0.765 . . . . 0.0 111.697 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.2 m -142.97 165.06 28.38 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 124.392 1.077 . . . . 0.0 108.688 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.0 -170.08 43.23 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.046 -178.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.84 158.81 29.47 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.908 0.883 . . . . 0.0 110.349 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.3 mt -139.96 158.71 43.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 108.665 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.6 148.63 28.87 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.171 -0.331 . . . . 0.0 111.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -123.77 170.91 10.06 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 124.818 1.247 . . . . 0.0 112.644 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.81 -10.64 59.7 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.739 0.415 . . . . 0.0 111.037 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -156.48 160.39 39.51 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.678 -0.639 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -69.81 -30.67 68.25 Favored 'General case' 0 C--N 1.337 0.055 0 C-N-CA 122.412 0.285 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.4 p -75.36 -27.38 59.12 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -74.16 -32.49 63.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.597 0.359 . . . . 0.0 111.22 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.21 -36.95 58.35 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 175.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 37.3 tp -70.57 -37.4 73.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.321 -0.237 . . . . 0.0 111.446 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -70.69 -39.82 73.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.251 0.8 OUTLIER -68.99 -20.25 64.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 175.261 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.05 -42.55 89.37 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.18 -30.13 75.27 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.684 -0.509 . . . . 0.0 111.949 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.337 9.6 m-85 -96.74 -2.97 43.27 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 66.0 mt -127.25 -9.13 5.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -73.87 147.01 43.65 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.689 1.132 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.451 ' CD2' HD22 ' A' ' 479' ' ' ASN . 2.0 t-80 57.58 22.12 7.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.807 0.843 . . . . 0.0 112.204 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.34 134.78 56.95 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -77.16 119.29 20.64 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 122.285 -0.26 . . . . 0.0 110.729 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 74.6 mtm -83.57 152.69 24.73 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.148 0.499 . . . . 0.0 112.107 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -73.6 166.39 23.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.123 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -146.22 145.04 22.79 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 122.176 0.19 . . . . 0.0 110.946 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.59 -34.02 3.64 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.174 2.583 . . . . 0.0 112.091 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -152.29 4.57 0.39 Allowed 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -69.18 146.46 44.46 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 -176.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.13 -18.46 21.07 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.841 3.027 . . . . 0.0 111.4 178.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -151.22 151.74 29.87 Favored Pre-proline 0 N--CA 1.455 -0.206 0 N-CA-C 114.598 1.332 . . . . 0.0 114.598 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.15 162.97 40.3 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.953 2.435 . . . . 0.0 110.849 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -129.91 142.31 50.67 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 103.348 -2.834 . . . . 0.0 103.348 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.6 OUTLIER -85.08 139.06 32.02 Favored 'General case' 0 CA--C 1.528 0.135 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -176.52 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 4.6 tt -85.22 145.79 27.4 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.541 ' HB2' ' HZ2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -133.47 151.92 51.84 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.044 -0.663 . . . . 0.0 111.036 178.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.62 165.14 37.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.583 0.552 . . . . 0.0 111.678 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 23.0 p -163.78 175.81 10.13 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.192 0.997 . . . . 0.0 110.257 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -58.89 125.49 23.77 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.409 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 35.6 t -82.17 152.07 26.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -171.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.3 t -118.26 12.71 13.53 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 169.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.05 161.3 24.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.826 0.85 . . . . 0.0 111.907 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -92.08 -3.2 56.05 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.414 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -152.84 169.98 21.46 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 123.84 0.856 . . . . 0.0 110.477 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.49 25.86 0.96 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.644 0.778 . . . . 0.0 110.148 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.502 -175.947 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.45 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.688 1 O4'-C1'-N19 112.379 4.179 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.647 0 C5'-C4'-C3' 110.406 -3.396 . 0.465 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.553 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.939 1 O4'-C1'-N19 112.552 4.352 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . 0.436 HO2' ' P ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.98 0 C5'-C4'-C3' 111.357 -2.762 . 0.0 OUTLIER '7D dist 4p' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.436 ' P ' HO2' ' B' ' 4' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 O4'-C1'-N19 112.45 4.25 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.512 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 C5'-C4'-C3' 110.103 -3.598 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 O4'-C1'-N19 110.616 2.416 . 0.012 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C3'-C2'-C1' 104.257 3.064 . 0.014 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.414 ' C6 ' ' HD2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.421 -2.666 0 O4'-C1'-N19 111.282 3.082 . 0.236 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 1 C5'-C4'-C3' 108.669 -4.554 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.278 16.4 t80 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -176.39 175.04 47.38 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 111.691 -0.564 . . . . 0.0 111.691 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -59.49 171.56 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 124.785 3.657 . . . . 0.0 112.969 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -150.0 155.99 40.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.276 0.63 . . . . 0.0 110.019 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.53 160.34 27.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.709 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.13 -0.92 33.68 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 36.1 t -155.19 148.58 18.49 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.921 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -60.79 -4.07 3.26 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 124.539 3.493 . . . . 0.0 113.945 176.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 p -139.67 157.22 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.106 0 CA-C-O 121.514 0.673 . . . . 0.0 109.319 -174.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.95 160.71 26.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.76 1.624 . . . . 0.0 109.09 -174.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 17.3 tpt -136.65 133.65 36.45 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 122.566 0.347 . . . . 0.0 110.717 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -126.93 152.68 35.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.407 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.7 m-85 -140.26 173.88 11.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.14 11.81 75.17 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.396 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 47.7 mt -78.74 23.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 117.396 0.598 . . . . 0.0 111.181 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.27 10.5 p30 -74.24 26.85 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -173.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.46 156.55 45.18 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.282 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 25.6 m -68.44 -7.29 30.54 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.422 0.689 . . . . 0.0 112.362 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.27 -14.71 61.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 94.2 mmm -100.99 149.6 23.76 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.516 0.598 . . . . 0.0 111.586 -178.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -157.19 151.03 24.47 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.88 0.872 . . . . 0.0 109.336 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.0 p -59.27 -39.45 82.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -174.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -72.02 -34.82 69.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.316 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -76.09 -48.26 21.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.452 0.301 . . . . 0.0 111.499 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.5 p -67.42 -37.4 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -76.9 -32.06 57.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -171.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -76.2 -32.44 58.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 119.589 1.086 . . . . 0.0 110.114 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.21 -54.62 30.06 Favored 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.8 OUTLIER -76.52 -4.18 41.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 172.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.338 0.073 0 O-C-N 121.912 -0.492 . . . . 0.0 110.428 177.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.11 -18.23 23.7 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.973 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -82.86 -10.48 58.82 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.94 -156.47 24.84 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 118.345 0.52 . . . . 0.0 112.287 -176.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -96.94 131.61 43.55 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.546 -0.385 . . . . 0.0 111.052 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.51 8.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -119.18 -70.68 0.78 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 14.8 pttp -154.48 168.36 26.97 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.2 p -137.32 149.8 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.187 0.995 . . . . 0.0 110.704 -177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -150.72 121.31 7.45 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.316 0.646 . . . . 0.0 111.51 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -85.21 158.92 20.22 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 13.4 mmt -116.37 133.49 55.95 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . 0.535 ' HE2' " H3'" ' B' ' 4' ' ' ' C' . 32.3 mttp -79.36 -23.79 43.11 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 124.254 1.022 . . . . 0.0 111.619 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.3 t -77.81 -19.63 54.64 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -170.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -113.12 156.96 42.14 Favored Pre-proline 0 CA--C 1.527 0.094 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.32 -15.17 47.23 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.617 2.211 . . . . 0.0 110.451 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.27 106.09 0.2 Allowed Glycine 0 C--N 1.338 0.642 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 175.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.83 157.36 29.06 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.41 0.684 . . . . 0.0 110.044 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.12 156.42 21.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.599 0.237 . . . . 0.0 111.636 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 64.5 mtm -102.49 154.11 19.42 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.338 0.655 . . . . 0.0 109.75 171.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 12.0 t -140.27 115.13 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 122.88 0.472 . . . . 0.0 111.23 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -93.77 133.42 37.16 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 44.3 mtp -154.75 172.43 17.95 Favored 'General case' 0 C--N 1.335 -0.045 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -171.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -64.69 118.13 8.47 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 168.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -72.4 -33.37 67.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -167.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.17 -88.27 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -71.65 -30.62 65.94 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.17 -32.71 18.48 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.564 -0.855 . . . . 0.0 112.729 -173.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 61.1 t -88.38 -24.08 6.22 Favored 'Isoleucine or valine' 0 C--N 1.343 0.296 0 CA-C-N 119.987 1.267 . . . . 0.0 109.685 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -66.07 -50.82 62.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.408 172.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -64.27 -34.51 78.29 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.23 82.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.5 0.591 . . . . 0.0 110.296 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.1 mt -79.17 -8.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.223 0.609 . . . . 0.0 111.089 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 37.6 m -100.61 -18.79 16.41 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 177.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -125.73 -29.82 3.1 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 -169.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 94.6 mt -134.36 -10.06 2.52 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 120.449 1.477 . . . . 0.0 114.151 -170.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.58 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.2 p-10 -71.38 100.74 2.24 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.503 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 9.8 m-80 76.72 21.44 1.24 Allowed 'General case' 0 N--CA 1.479 1.025 0 O-C-N 117.795 -3.066 . . . . 0.0 112.477 -162.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -79.61 158.44 27.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 170.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.29 46.7 m-85 -72.85 42.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -174.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' MET . . . . . 0.427 ' HG2' ' CD2' ' A' ' 442' ' ' PHE . 16.0 ttt -59.74 145.98 43.14 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.791 -0.568 . . . . 0.0 110.43 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.427 ' CD2' ' HG2' ' A' ' 441' ' ' MET 0.289 62.0 m-85 55.92 8.82 0.39 Allowed 'General case' 0 C--O 1.231 0.104 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 72.62 13.58 77.95 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -175.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -133.02 -4.41 3.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.672 0.736 . . . . 0.0 112.19 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 62.99 150.99 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.439 1.496 . . . . 0.0 114.069 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.55 110.4 7.19 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 171.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.503 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.5 m120 -65.61 130.33 42.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 115.885 -2.007 . . . . 0.0 112.061 -171.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.58 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.426 1.9 t -127.62 150.08 33.14 Favored 'Isoleucine or valine' 0 C--N 1.362 1.145 0 C-N-CA 113.031 -3.468 . . . . 0.0 116.249 169.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.7 t -161.04 172.38 16.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.778 1.231 . . . . 0.0 108.139 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.9 p -71.24 146.7 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 17.4 t -80.47 155.77 26.89 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 122.861 0.464 . . . . 0.0 111.192 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.426 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 62.9 pttt -103.43 -4.01 24.66 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 121.959 0.104 . . . . 0.0 111.068 177.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -82.93 156.18 67.43 Favored Pre-proline 0 N--CA 1.455 -0.181 0 C-N-CA 123.038 0.535 . . . . 0.0 110.276 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -74.84 -37.75 2.01 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.89 2.394 . . . . 0.0 112.144 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.89 163.16 11.57 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.511 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.7 mt -82.3 138.76 18.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 45.8 mmm -102.2 123.65 42.56 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 122.67 0.388 . . . . 0.0 110.506 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -73.7 153.47 48.69 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.19 2.593 . . . . 0.0 109.374 174.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.8 -123.81 1.39 Allowed Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.907 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -72.49 163.85 27.35 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.914 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 470' ' ' SER . 97.5 p -151.21 176.22 11.41 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.123 0.969 . . . . 0.0 109.351 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.407 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 34.8 p90 -136.93 7.08 2.93 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.335 -0.228 . . . . 0.0 111.127 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.55 -172.71 55.14 Favored Glycine 0 CA--C 1.526 0.734 0 O-C-N 122.202 -0.311 . . . . 0.0 112.47 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 75.2 mt -144.92 170.09 16.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.761 1.224 . . . . 0.0 109.586 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -70.09 -28.81 65.71 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.001 -0.437 . . . . 0.0 111.129 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -120.62 9.71 10.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -142.05 164.3 26.86 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 91.8 p -94.51 -22.56 18.16 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.592 0.357 . . . . 0.0 111.94 -176.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.5 t -127.01 146.88 50.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.878 0.471 . . . . 0.0 110.328 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 461' ' ' SER . 89.0 p -88.65 9.54 23.83 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.779 0.832 . . . . 0.0 110.838 176.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -141.34 150.7 42.81 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.002 1.321 . . . . 0.0 114.328 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -155.93 148.07 23.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.992 0.36 . . . . 0.0 111.099 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -100.74 146.35 27.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -140.38 1.45 1.77 Allowed 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 89.8 p -66.28 -19.35 65.79 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.337 0.655 . . . . 0.0 112.039 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -114.03 2.86 15.11 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.512 0.725 . . . . 0.0 111.152 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -76.15 150.03 37.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.976 0.417 . . . . 0.0 111.611 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -81.44 -11.88 59.1 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.538 0.735 . . . . 0.0 110.656 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -66.22 -18.12 65.16 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -63.33 131.1 47.19 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.718 0.407 . . . . 0.0 110.457 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.2 tpt85 -80.93 -33.77 33.83 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.318 62.9 m-85 -98.0 9.14 43.52 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 117.889 2.551 . . . . 0.0 117.889 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 28.2 m -75.53 -3.58 34.99 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.04 147.72 61.86 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -71.7 -24.77 21.29 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.269 2.646 . . . . 0.0 111.466 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -82.87 -25.78 32.21 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.003 0.365 . . . . 0.0 110.601 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -80.07 -43.94 20.93 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.143 -0.348 . . . . 0.0 110.185 173.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -58.76 -18.63 33.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.02 -19.24 44.31 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -124.05 8.13 8.62 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -65.13 154.11 38.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.135 0.425 . . . . 0.0 111.448 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.419 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 10.9 ptp180 -151.42 137.07 17.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.8 mm -141.55 140.57 31.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.058 0 C-N-CA 123.526 0.73 . . . . 0.0 109.39 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -149.42 169.28 21.23 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.07 0.948 . . . . 0.0 109.948 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -60.15 152.92 59.87 Favored Pre-proline 0 N--CA 1.455 -0.185 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.37 156.12 61.92 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.996 2.464 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 44.3 t -154.83 175.77 13.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.7 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -83.66 -4.86 58.95 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.283 -0.26 . . . . 0.0 110.423 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -94.01 138.2 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 176.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 82.9 mt -126.31 153.7 44.48 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.268 0.627 . . . . 0.0 109.855 175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -124.0 131.1 53.52 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -123.93 158.41 32.05 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 -176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -143.75 150.59 38.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -174.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 50.93 57.09 7.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.748 1.219 . . . . 0.0 112.728 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.12 160.58 25.51 Favored Pre-proline 0 N--CA 1.454 -0.251 0 C-N-CA 123.594 0.758 . . . . 0.0 110.265 175.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.46 152.1 27.81 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.265 2.643 . . . . 0.0 112.535 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.57 -16.51 63.89 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.872 0.469 . . . . 0.0 111.934 -177.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -122.94 25.88 8.38 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.876 0.87 . . . . 0.0 110.751 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -64.61 -13.91 15.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.59 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.5 OUTLIER -54.81 -177.41 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -165.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.59 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.46 -39.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -169.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.0 mt-10 -59.74 -43.65 94.16 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 172.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.96 -28.78 21.25 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 122.181 2.264 . . . . 0.0 106.873 -174.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -66.98 -33.34 75.36 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -76.53 -42.19 44.03 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -73.2 -26.34 61.12 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 75.6 mt -76.9 -41.33 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.162 0.437 . . . . 0.0 110.902 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 89.8 m -68.34 -35.09 77.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.178 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -69.45 -38.49 77.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -71.1 -27.74 63.81 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.509 0.323 . . . . 0.0 111.533 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.8 mt -93.53 -4.1 51.64 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.8 0.44 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.07 32.56 58.4 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.943 -0.473 . . . . 0.0 112.626 175.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.6 m -127.03 164.68 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 117.554 0.677 . . . . 0.0 111.585 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.52 142.9 57.36 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -83.58 153.8 65.08 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.25 146.66 76.56 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 123.017 2.478 . . . . 0.0 110.729 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.1 t -85.01 -15.82 42.88 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.0 t -150.32 153.08 35.47 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.808 0.443 . . . . 0.0 109.878 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 72.8 t -141.67 145.3 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 123.39 0.676 . . . . 0.0 109.91 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -145.81 138.12 25.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.352 0.661 . . . . 0.0 109.365 176.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 18.4 t -141.77 140.16 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 C-N-CA 123.667 0.787 . . . . 0.0 110.393 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -155.36 169.08 25.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 -176.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.3 p -79.53 170.47 16.52 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.806 0.842 . . . . 0.0 111.485 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . 0.459 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 82.68 -174.38 53.04 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.941 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 62.7 -19.44 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.151 1.78 . . . . 0.0 113.86 -177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' SER . . . . . 0.459 ' H ' ' C ' ' A' ' 534' ' ' GLY . 43.8 t -161.67 157.93 25.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 110.228 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -116.96 -7.77 11.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.505 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -88.14 -34.8 17.74 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 123.363 0.665 . . . . 0.0 112.237 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 4.0 m -160.59 170.68 20.38 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.016 0.526 . . . . 0.0 111.283 -173.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.4 t -79.89 165.5 22.61 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.44 0.696 . . . . 0.0 111.567 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.6 m -147.89 161.8 40.57 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.413 1.085 . . . . 0.0 109.588 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.56 -170.6 43.74 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.963 -178.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -119.16 159.96 23.01 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.943 0.897 . . . . 0.0 110.356 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.2 mt -141.46 159.79 41.49 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 108.94 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -150.26 149.22 29.86 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 117.782 0.264 . . . . 0.0 111.355 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.0 m-90 -124.42 171.91 9.57 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 124.986 1.314 . . . . 0.0 112.48 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -74.48 -12.38 60.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.389 0.276 . . . . 0.0 110.478 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.5 t -157.51 156.06 31.37 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 121.707 -0.62 . . . . 0.0 111.135 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -23.24 63.45 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 122.256 -0.278 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 51.3 m -78.22 -25.29 46.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -78.09 -32.23 50.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.54 0.336 . . . . 0.0 110.708 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.07 -25.56 58.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.334 -0.228 . . . . 0.0 110.431 175.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 60.1 tp -74.66 -41.58 60.04 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.274 -0.266 . . . . 0.0 110.962 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.77 -35.74 75.16 Favored 'General case' 0 N--CA 1.456 -0.145 0 O-C-N 121.965 -0.459 . . . . 0.0 109.903 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.95 -23.57 55.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 177.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.84 -39.44 90.79 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.89 -37.35 88.08 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.339 27.7 m-85 -84.47 -4.59 59.02 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 118.85 2.907 . . . . 0.0 118.85 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 85.5 mt -122.15 -22.0 5.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.049 0.84 . . . . 0.0 113.09 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -70.85 139.17 50.77 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 119.369 0.986 . . . . 0.0 110.388 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 58.91 12.78 2.47 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.645 1.178 . . . . 0.0 112.968 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.268 36.6 t80 -71.25 140.8 50.52 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -72.2 137.8 47.14 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.156 -0.34 . . . . 0.0 111.704 -175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.9 mtm -83.41 145.28 29.08 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 122.356 0.263 . . . . 0.0 110.802 177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -81.07 166.25 20.91 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -148.79 149.57 30.87 Favored Pre-proline 0 CA--C 1.53 0.181 0 C-N-CA 122.644 0.378 . . . . 0.0 110.803 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -74.13 -27.97 11.27 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 112.112 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 37.7 p30 -160.3 8.78 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -68.01 149.46 50.27 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.04 -26.05 13.35 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.622 2.882 . . . . 0.0 111.489 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -154.9 148.04 18.26 Favored Pre-proline 0 CA--C 1.529 0.154 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.87 164.98 27.11 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.902 3.068 . . . . 0.0 111.96 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -130.0 142.3 50.65 Favored 'General case' 0 C--O 1.23 0.069 0 N-CA-C 102.618 -3.104 . . . . 0.0 102.618 173.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.262 0.7 OUTLIER -74.64 138.31 42.82 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.7 tt -89.59 147.1 24.12 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.507 ' HB2' ' HZ3' ' A' ' 576' ' ' LYS . 0.2 OUTLIER -140.34 158.53 43.88 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.574 -178.776 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.93 169.36 23.67 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.232 0.539 . . . . 0.0 111.041 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 51.5 t -155.91 164.07 38.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.445 1.098 . . . . 0.0 109.377 -175.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -57.36 121.07 9.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 174.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.453 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 41.5 t -75.79 144.6 41.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -169.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 t -112.25 13.52 20.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.88 -1.054 . . . . 0.0 113.684 169.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.28 162.92 13.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.242 1.017 . . . . 0.0 111.909 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -87.35 -3.07 59.02 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.967 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -177.52 176.57 1.26 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.32 1.048 . . . . 0.0 110.081 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -137.19 23.3 3.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.657 0.783 . . . . 0.0 110.917 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.129 -1.415 . . . . 0.0 111.09 -177.195 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.407 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.751 1 O4'-C1'-N19 112.68 4.48 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . 0.426 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C5'-C4'-C3' 110.962 -3.025 . 0.436 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.444 " O5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.78 0 C3'-C2'-C1' 104.892 3.769 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . 0.535 " H3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.417 -2.969 1 P-O3'-C3' 125.998 5.248 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.475 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.939 1 O4'-C1'-N19 112.81 4.61 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.511 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 C5'-C4'-C3' 110.029 -3.647 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.922 0 C5'-C4'-C3' 111.558 -2.628 . 0.01 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C3'-C2'-C1' 104.821 3.69 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.453 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.765 0 O4'-C1'-N19 111.207 3.007 . 0.221 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.62 1 C5'-C4'-C3' 108.802 -4.465 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.262 51.5 m-85 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.12 -174.31 44.31 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.63 170.49 16.3 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 124.16 3.24 . . . . 0.0 111.166 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -151.93 156.4 40.0 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.233 0.613 . . . . 0.0 110.376 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.21 157.45 37.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.676 0.39 . . . . 0.0 110.836 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -83.35 6.69 19.02 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -154.28 145.05 16.11 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.119 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.36 -7.39 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.911 3.074 . . . . 0.0 112.686 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.41 154.43 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -173.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.2 tt -132.36 154.55 49.64 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.76 1.624 . . . . 0.0 108.103 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 13.9 tpt -134.95 136.49 42.3 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.308 0.243 . . . . 0.0 110.949 -174.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -130.62 151.59 36.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -175.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.419 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.0 m-85 -137.2 172.74 12.54 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.54 11.11 80.66 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.843 -0.421 . . . . 0.0 112.881 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.5 mt -77.97 28.04 0.18 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.802 0.801 . . . . 0.0 112.25 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.42 -39.17 91.8 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -66.61 148.69 51.56 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.094 0.473 . . . . 0.0 111.147 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.6 p -70.61 -6.72 38.84 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.887 0.875 . . . . 0.0 113.008 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -78.54 -13.45 59.82 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.61 0.364 . . . . 0.0 111.611 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 70.0 mmm -84.69 148.98 26.11 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -163.03 162.21 25.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 16.6 p -59.68 -32.31 70.37 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 122.112 -0.368 . . . . 0.0 111.267 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -73.29 -30.71 63.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.27 -51.67 14.62 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 12.5 m -65.03 -39.0 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.875 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.528 ' CE1' HG11 ' A' ' 406' ' ' VAL 0.358 1.9 m-85 -67.85 -51.89 43.04 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 175.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -58.08 -36.34 72.71 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.255 -173.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 28.5 t -60.4 -64.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.334 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.504 5.3 p90 -76.51 -5.82 49.17 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 118.226 2.676 . . . . 0.0 118.226 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.62 -32.42 53.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.998 0.519 . . . . 0.0 110.036 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -59.2 -17.73 30.25 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.008 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -89.87 -17.5 27.94 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.73 179.36 44.32 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 118.494 0.588 . . . . 0.0 112.941 -176.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -75.33 146.74 40.7 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -175.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.528 HG11 ' CE1' ' A' ' 397' ' ' PHE . 24.1 t -114.15 163.35 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.979 1.311 . . . . 0.0 113.206 -172.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -132.87 -66.89 0.65 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.192 -0.432 . . . . 0.0 111.726 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -153.31 156.51 38.51 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.745 0.702 . . . . 0.0 112.833 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . 0.525 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.8 p -141.43 148.03 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 174.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -153.5 123.88 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.617 0.246 . . . . 0.0 111.312 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -74.76 162.37 28.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 66.4 mtm -135.11 126.67 28.8 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 121.347 0.594 . . . . 0.0 112.118 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -5.58 54.65 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 124.509 1.124 . . . . 0.0 111.801 176.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 91.6 p -77.96 -4.02 44.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.759 0.424 . . . . 0.0 111.208 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.413 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.5 mmtm -138.49 158.51 70.35 Favored Pre-proline 0 CA--C 1.529 0.159 0 C-N-CA 124.492 1.117 . . . . 0.0 109.484 178.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.32 -13.68 40.93 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.149 2.566 . . . . 0.0 111.614 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.32 99.27 0.12 Allowed Glycine 0 C--N 1.336 0.534 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 175.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.94 156.76 35.1 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.814 0.446 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -155.95 146.28 21.68 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 111.219 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 81.4 mtp -88.61 147.84 24.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.1 t -142.13 118.5 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -102.34 134.17 46.06 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 70.0 mtp -153.71 173.91 15.21 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.58 116.96 7.38 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 169.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -72.25 -33.24 67.36 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -167.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.83 -87.35 0.02 OUTLIER Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -74.31 -24.42 59.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.93 -34.92 16.74 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.974 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 69.9 t -84.84 -25.04 7.02 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 118.573 -1.251 . . . . 0.0 109.041 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -66.66 -54.29 24.72 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.913 0.324 . . . . 0.0 111.647 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -64.3 -37.21 86.7 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.52 -35.13 77.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.239 0.472 . . . . 0.0 110.786 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.67 -10.68 12.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.523 0.329 . . . . 0.0 110.919 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 58.6 m -96.76 -20.31 18.31 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -125.61 -31.48 2.97 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.43 HD23 HD21 ' A' ' 439' ' ' ASN . 90.8 mt -134.26 -7.26 2.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.333 1.424 . . . . 0.0 114.299 -169.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.565 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.1 p-10 -71.17 100.94 2.16 Favored 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 -170.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.524 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 9.2 m-80 76.92 21.23 1.18 Allowed 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 123.97 3.077 . . . . 0.0 112.156 -162.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . 0.43 HD21 HD23 ' A' ' 436' ' ' LEU . 55.7 t30 -84.76 159.44 20.47 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 169.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -75.85 138.8 41.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' MET . . . . . 0.4 ' HE2' ' CE2' ' A' ' 442' ' ' PHE . 19.4 ttt -160.25 145.58 14.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.566 0.746 . . . . 0.0 109.081 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.4 ' CE2' ' HE2' ' A' ' 441' ' ' MET . 62.1 m-85 60.06 15.57 5.22 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.07 11.41 84.46 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -133.94 -161.44 1.14 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.608 1.563 . . . . 0.0 108.47 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.16 151.14 50.39 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 121.963 -0.461 . . . . 0.0 110.683 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -130.34 91.12 3.04 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.524 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.6 m120 -58.93 128.21 36.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 115.863 -2.018 . . . . 0.0 111.721 -173.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.565 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.42 1.9 t -128.21 150.47 33.98 Favored 'Isoleucine or valine' 0 C--N 1.367 1.348 0 C-N-CA 113.113 -3.435 . . . . 0.0 116.076 170.157 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 48.6 t -159.94 167.84 27.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.298 1.439 . . . . 0.0 108.618 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -70.74 148.93 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 21.4 t -85.01 158.13 20.56 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.783 0.433 . . . . 0.0 111.497 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -107.44 -1.33 21.57 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.386 0.275 . . . . 0.0 111.45 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -85.13 149.01 51.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.792 0.437 . . . . 0.0 110.621 175.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.47 -33.57 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.211 2.607 . . . . 0.0 112.542 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.07 157.79 11.71 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.064 0.393 . . . . 0.0 111.715 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 81.2 mt -83.39 145.23 8.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.4 mtp -114.75 126.98 27.26 Favored Pre-proline 0 CA--C 1.532 0.256 0 O-C-N 122.342 -0.224 . . . . 0.0 110.844 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.13 173.6 14.15 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 124.134 3.223 . . . . 0.0 110.286 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 136.63 -107.78 0.62 Allowed Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.034 -0.827 . . . . 0.0 111.034 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.37 158.34 35.96 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.326 0.65 . . . . 0.0 111.054 -177.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 40.6 t -161.1 163.81 31.15 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.8 0.84 . . . . 0.0 109.466 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -130.56 0.41 4.45 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.03 -177.3 54.37 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 122.934 0.302 . . . . 0.0 112.491 -178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.5 mt -143.7 157.75 44.17 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 124.343 1.057 . . . . 0.0 109.338 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.5 pm0 -71.82 -10.22 59.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.779 0.431 . . . . 0.0 112.073 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -120.48 20.25 11.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.323 0.649 . . . . 0.0 110.237 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -168.35 -151.74 7.27 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.0 t -133.05 -16.1 2.52 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.8 p -127.06 146.82 50.23 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.374 0.669 . . . . 0.0 111.4 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 93.1 p -92.44 -0.11 57.39 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.862 0.465 . . . . 0.0 110.434 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -126.81 144.96 50.81 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -155.37 156.68 35.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.257 0.2 OUTLIER -136.69 142.74 43.15 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -129.24 12.33 6.03 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 32.2 t -64.04 -25.14 67.98 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.465 0.706 . . . . 0.0 112.013 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -114.0 3.84 15.49 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.351 0.661 . . . . 0.0 111.62 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 45.4 t -75.82 153.6 36.77 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 111.687 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 54.4 ttt180 -83.42 -14.48 52.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.259 0.624 . . . . 0.0 110.717 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -63.24 -22.29 66.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.121 0.568 . . . . 0.0 112.255 -174.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -58.03 130.83 48.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -68.88 -33.84 74.45 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -170.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.413 56.9 m-85 -98.0 17.35 18.53 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.1 t -61.58 -25.73 67.51 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -172.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.57 151.84 76.72 Favored Pre-proline 0 C--O 1.232 0.14 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -177.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.09 -15.66 39.77 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.006 2.471 . . . . 0.0 109.872 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.8 -32.73 60.0 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -80.6 -47.09 14.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 174.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.78 -21.43 65.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.94 -22.55 55.86 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.22 -0.3 . . . . 0.0 111.647 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -124.05 -1.81 8.24 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -60.25 153.93 21.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.425 0.557 . . . . 0.0 111.655 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -152.86 147.34 25.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.5 mm -135.82 147.55 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 C-N-CA 123.252 0.621 . . . . 0.0 109.578 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -156.56 160.54 39.56 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.019 0.528 . . . . 0.0 110.044 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -61.01 155.09 56.78 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.749 0.42 . . . . 0.0 109.999 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.68 146.67 89.13 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.099 2.533 . . . . 0.0 111.065 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 92.5 p -151.48 176.66 11.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.552 0.741 . . . . 0.0 109.627 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -83.71 -2.14 55.59 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.03 142.93 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 123.199 0.6 . . . . 0.0 112.124 175.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.2 tp -137.69 151.75 48.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -124.22 149.99 45.77 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.783 0.833 . . . . 0.0 109.149 -177.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -142.11 159.9 41.29 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.612 0.72 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -149.69 160.04 43.85 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 102.719 -3.067 . . . . 0.0 102.719 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 58.45 57.39 3.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.327 -0.233 . . . . 0.0 111.472 -174.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -123.17 148.51 54.9 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 122.589 0.356 . . . . 0.0 111.202 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.24 155.47 29.45 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.67 2.913 . . . . 0.0 112.794 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.16 -16.38 63.97 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.324 0.649 . . . . 0.0 111.724 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -120.33 20.95 11.85 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.69 0.796 . . . . 0.0 111.183 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.58 -13.91 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.588 HG21 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.82 -177.3 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -166.158 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.588 ' H ' HG21 ' A' ' 510' ' ' THR . 23.1 pt-20 -24.05 -40.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.6 mt-10 -58.53 -46.22 87.27 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.289 -1.338 . . . . 0.0 114.449 173.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -87.93 -27.96 21.8 Favored 'General case' 0 C--N 1.351 0.635 0 CA-C-N 122.653 2.479 . . . . 0.0 106.669 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -63.7 -38.07 89.72 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -75.6 -42.7 51.19 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -75.07 -20.91 59.29 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.132 -177.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -77.29 -39.92 28.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 118.268 0.486 . . . . 0.0 110.032 175.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.7 m -69.02 -31.39 70.17 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 122.137 -0.352 . . . . 0.0 110.838 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -72.7 -32.93 66.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.42 0.288 . . . . 0.0 110.692 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -71.74 -27.72 63.18 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.76 -5.96 37.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.818 0.281 . . . . 0.0 111.68 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.93 -7.83 8.91 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 123.678 0.656 . . . . 0.0 113.362 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.2 m -77.34 174.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 118.41 1.105 . . . . 0.0 112.784 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.73 164.52 6.07 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 123.295 0.638 . . . . 0.0 111.922 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -127.16 150.14 71.45 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.587 0.755 . . . . 0.0 109.281 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.11 154.68 69.92 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.095 2.53 . . . . 0.0 111.631 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.9 t -89.33 -17.11 29.56 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 17.3 t -155.48 155.27 33.17 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.523 0.329 . . . . 0.0 110.208 177.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.5 m -141.79 155.22 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -147.56 141.2 25.57 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.597 0.759 . . . . 0.0 109.473 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.33 141.91 29.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.302 0.641 . . . . 0.0 111.796 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -155.23 167.57 29.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -91.02 175.14 7.06 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.917 0.887 . . . . 0.0 110.785 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 95.26 177.07 37.55 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 123.591 0.615 . . . . 0.0 111.71 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . 0.463 ' HZ2' ' HB3' ' A' ' 535' ' ' LYS . 0.2 OUTLIER 49.7 13.34 0.09 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.701 2.0 . . . . 0.0 114.432 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -160.85 157.65 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 123.797 0.839 . . . . 0.0 109.766 177.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -117.09 6.17 12.86 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -141.22 -10.62 0.96 Allowed 'General case' 0 C--N 1.341 0.198 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 45.2 t -154.31 163.85 39.5 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.463 0.574 . . . . 0.0 111.707 -170.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 60.1 p -90.11 173.63 8.07 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 111.349 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.5 m -145.72 165.8 27.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.595 1.158 . . . . 0.0 108.786 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.56 -174.27 46.06 Favored Glycine 0 CA--C 1.525 0.661 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.959 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.82 161.3 22.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.792 0.837 . . . . 0.0 110.299 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.1 mt -140.64 161.57 37.45 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.885 1.274 . . . . 0.0 108.784 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -148.05 149.76 32.68 Favored 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.936 0.346 . . . . 0.0 111.936 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -127.48 172.14 10.96 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.638 1.575 . . . . 0.0 112.333 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.21 -9.99 59.16 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.4 t -161.38 158.45 26.89 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.092 0.557 . . . . 0.0 110.339 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -73.52 -19.87 60.81 Favored 'General case' 0 CA--C 1.527 0.074 0 O-C-N 122.294 -0.254 . . . . 0.0 111.175 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 86.7 p -79.83 -25.48 40.78 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.92 0.327 . . . . 0.0 110.158 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -76.81 -35.85 57.33 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.323 0.249 . . . . 0.0 111.173 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.32 62.14 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 36.0 tp -73.89 -41.48 62.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.895 0.478 . . . . 0.0 110.12 178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -63.07 -47.07 84.49 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.061 0.457 . . . . 0.0 110.551 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -26.1 63.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 177.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.4 -38.9 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -63.78 -40.46 98.49 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.355 30.1 m-85 -91.13 -3.66 56.88 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 119.362 3.097 . . . . 0.0 119.362 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 74.5 mt -120.3 -4.86 9.92 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.498 1.045 . . . . 0.0 113.482 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -74.66 143.61 44.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.344 0.974 . . . . 0.0 108.54 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 58.07 19.28 5.87 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.591 0.757 . . . . 0.0 112.331 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -71.31 155.47 40.63 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -177.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -70.54 157.9 37.07 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.2 mtm -126.66 152.71 46.37 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.187 0.595 . . . . 0.0 111.917 173.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -74.83 161.0 29.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 169.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -153.61 118.01 2.76 Favored Pre-proline 0 CA--C 1.531 0.247 0 O-C-N 121.991 -0.443 . . . . 0.0 110.817 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -80.6 -16.37 10.5 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.32 2.68 . . . . 0.0 111.864 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.01 -7.8 58.98 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 173.68 170.65 37.38 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.94 -21.14 21.31 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.698 2.932 . . . . 0.0 111.6 -178.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -82.62 131.74 54.1 Favored Pre-proline 0 N--CA 1.454 -0.232 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -83.57 169.25 12.35 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.616 2.877 . . . . 0.0 111.143 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -130.03 142.32 50.63 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 102.834 -3.024 . . . . 0.0 102.834 172.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -76.65 137.14 39.25 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 116.316 1.969 . . . . 0.0 116.316 -175.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.7 tt -87.42 150.03 24.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.437 1.095 . . . . 0.0 108.625 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -141.43 153.95 45.3 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.48 161.44 40.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.938 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.5 p -163.27 171.28 16.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.281 0.633 . . . . 0.0 111.626 -175.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -54.34 121.67 8.76 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.407 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 39.4 t -80.52 149.04 30.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -169.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 1.0 OUTLIER -111.68 9.22 20.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 169.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.41 168.75 15.4 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.261 1.025 . . . . 0.0 111.801 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -95.47 -3.12 47.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -175.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.74 178.03 4.24 Favored 'General case' 0 C--N 1.338 0.086 0 C-N-CA 123.346 0.659 . . . . 0.0 110.216 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.2 31.49 1.37 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.776 0.43 . . . . 0.0 111.768 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.252 1.192 0 CA-C-O 117.779 -1.105 . . . . 0.0 110.942 -178.879 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.419 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.692 1 O4'-C1'-N19 112.718 4.518 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 C5'-C4'-C3' 110.645 -3.237 . 0.428 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.702 2 C5'-C4'-C3' 106.239 -6.174 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 1 C5'-C4'-C3' 109.23 -4.18 . 0.01 2u . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.912 1 O4'-C1'-N19 114.009 5.809 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.485 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C5'-C4'-C3' 109.77 -3.82 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 O4'-C1'-N19 111.978 3.778 . 0.037 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C3'-C2'-C1' 104.566 3.407 . 0.107 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.407 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C5'-C4'-C3' 111.516 -2.656 . 0.279 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 2 C5'-C4'-C3' 108.113 -4.925 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.339 6.3 p90 . . . . . 0 N--CA 1.473 0.675 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -77.3 152.33 39.67 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -62.14 151.72 80.22 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.705 2.937 . . . . 0.0 111.943 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -78.2 155.41 30.38 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.952 0.501 . . . . 0.0 110.017 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -71.93 155.47 40.32 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.808 0.337 . . . . 0.0 110.714 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -84.59 7.82 18.86 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 38.3 t -151.6 143.49 16.09 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 122.051 -0.406 . . . . 0.0 110.947 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.12 -1.39 2.86 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.292 3.328 . . . . 0.0 113.976 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.4 p -143.01 156.24 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-O 121.809 0.814 . . . . 0.0 109.202 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.54 164.17 24.37 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.078 1.751 . . . . 0.0 107.825 -177.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.1 ttt -144.13 138.64 28.32 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.816 0.735 . . . . 0.0 111.855 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.7 154.54 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 C-N-CA 124.136 0.974 . . . . 0.0 108.588 -175.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -141.89 171.8 13.56 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.94 10.63 75.11 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 112.057 -0.417 . . . . 0.0 112.057 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 53.8 mt -79.03 26.51 0.25 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.761 0.78 . . . . 0.0 111.879 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -62.9 -35.57 80.49 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -67.19 150.64 48.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.2 p -69.81 -7.17 37.63 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 123.687 0.795 . . . . 0.0 112.705 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -79.12 -7.39 58.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.367 0.667 . . . . 0.0 112.311 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 69.1 mmm -91.27 151.9 20.71 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.632 0.651 . . . . 0.0 111.259 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -159.54 155.51 26.49 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.574 0.75 . . . . 0.0 109.754 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 10.8 p -60.24 -38.36 83.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.29 -30.76 63.62 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -75.87 -43.28 46.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.656 0.382 . . . . 0.0 111.082 -177.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.497 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 1.1 m-85 -62.39 -53.39 55.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.099 2.259 . . . . 0.0 117.099 177.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -60.47 -32.49 71.45 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.351 -1.34 . . . . 0.0 109.787 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 11.0 t -60.92 -62.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.4 OUTLIER -76.54 -8.11 56.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 175.822 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.9 t -73.11 -29.66 63.08 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.917 -0.49 . . . . 0.0 109.951 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . 0.552 ' HB2' ' HG ' ' A' ' 578' ' ' CYS . 2.0 pp -60.18 -16.26 31.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.074 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -94.87 -6.86 41.77 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.104 2.261 . . . . 0.0 117.104 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.2 175.49 32.28 Favored Glycine 0 CA--C 1.527 0.844 0 CA-C-N 118.35 0.523 . . . . 0.0 112.85 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -70.35 137.31 50.47 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 111.719 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.497 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 15.1 m -114.03 165.31 9.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 124.959 1.304 . . . . 0.0 109.397 -176.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -139.39 -54.65 0.57 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -151.39 152.46 33.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.792 1.178 . . . . 0.0 112.972 -176.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 13.9 p -141.5 145.12 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 123.424 0.69 . . . . 0.0 109.914 176.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -153.6 128.23 9.37 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.872 0.469 . . . . 0.0 110.673 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -80.5 147.83 30.7 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 117.08 2.252 . . . . 0.0 117.08 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.1 mmt -83.3 128.55 34.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.431 0.692 . . . . 0.0 111.409 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . 0.652 ' HE2' " H3'" ' B' ' 4' ' ' ' C' . 36.6 mttp -79.3 -30.14 42.77 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 122.98 0.512 . . . . 0.0 111.108 173.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 28.4 t -79.77 -19.46 48.6 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.925 0.89 . . . . 0.0 112.956 -174.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -108.84 154.15 41.98 Favored Pre-proline 0 N--CA 1.455 -0.191 0 C-N-CA 123.068 0.547 . . . . 0.0 110.179 -175.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -67.96 -17.54 46.34 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.109 2.54 . . . . 0.0 111.293 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.45 103.68 0.17 Allowed Glycine 0 C--N 1.336 0.576 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -163.74 160.74 22.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.49 0.716 . . . . 0.0 109.385 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.47 143.11 16.06 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 79.4 mtp -81.18 149.55 29.05 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.3 t -142.68 102.05 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -84.51 134.38 34.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 75.0 mtp -153.6 171.46 18.73 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 123.723 0.809 . . . . 0.0 109.716 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -67.49 114.73 6.39 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 169.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -72.43 -33.87 67.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -166.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -52.49 -89.16 0.01 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.251 55.5 m-85 -77.93 -20.66 52.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 117.389 2.366 . . . . 0.0 117.389 -176.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -89.0 -35.76 16.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 119.021 -1.071 . . . . 0.0 111.673 -176.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.6 t -84.82 -26.67 6.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.221 0 C-N-CA 118.722 -1.191 . . . . 0.0 108.24 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -62.14 -62.88 1.46 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 173.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -65.83 -29.14 69.56 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.34 -36.13 78.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.736 0.698 . . . . 0.0 110.401 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 -11.49 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.907 0.483 . . . . 0.0 110.793 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.8 m -94.53 -21.85 18.6 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -130.13 -19.26 3.21 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -169.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.72 -12.33 2.3 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.669 1.577 . . . . 0.0 114.573 -175.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.559 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.51 100.98 2.35 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -169.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.557 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 11.1 m-80 76.91 22.05 1.1 Allowed 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 124.05 3.114 . . . . 0.0 113.21 -162.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.84 159.09 25.17 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.593 -0.692 . . . . 0.0 110.117 167.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.26 137.98 41.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 15.8 ttt -157.77 141.18 15.41 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.256 0.623 . . . . 0.0 109.665 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 58.55 16.65 4.39 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 81.63 11.3 83.18 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -132.66 -161.83 1.17 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.782 1.633 . . . . 0.0 108.373 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.78 149.23 49.06 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.886 -0.509 . . . . 0.0 110.8 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -126.39 82.36 2.07 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.446 0.698 . . . . 0.0 109.417 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.557 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.1 m120 -54.41 127.95 29.65 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 115.497 -2.192 . . . . 0.0 112.678 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.559 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.0 t -127.77 149.17 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 113.464 -3.294 . . . . 0.0 116.519 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.43 168.55 24.92 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.281 1.432 . . . . 0.0 107.653 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.89 150.07 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.1 t -88.62 157.98 18.4 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.133 0.573 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -105.51 -3.47 22.41 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.446 0.298 . . . . 0.0 111.182 178.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -75.49 156.58 85.12 Favored Pre-proline 0 CA--C 1.53 0.207 0 C-N-CA 123.259 0.624 . . . . 0.0 110.467 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.85 -35.47 0.99 Allowed 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.897 2.398 . . . . 0.0 112.193 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.57 167.94 9.47 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.393 0.677 . . . . 0.0 110.399 -175.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 65.5 mt -93.89 136.43 25.49 Favored 'Isoleucine or valine' 0 C--O 1.23 0.063 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 69.7 mmm -85.27 130.66 50.91 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-O 119.719 -0.182 . . . . 0.0 110.685 175.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -77.77 27.82 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.807 3.671 . . . . 0.0 111.341 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -74.54 -143.41 0.86 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.955 0.788 . . . . 0.0 113.535 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -72.53 166.95 21.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.727 0.811 . . . . 0.0 111.366 -174.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -146.11 175.46 10.46 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.928 0.891 . . . . 0.0 110.8 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.539 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 32.3 p90 -141.28 -178.4 5.58 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.734 0.813 . . . . 0.0 108.847 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.82 177.18 45.01 Favored Glycine 0 CA--C 1.528 0.867 0 O-C-N 122.031 -0.418 . . . . 0.0 113.02 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 28.0 mt -140.94 168.61 19.37 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 124.24 1.016 . . . . 0.0 109.745 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -71.78 -31.22 66.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.325 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -120.57 18.47 12.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.768 0.427 . . . . 0.0 110.442 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.28 172.99 42.43 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.495 -0.753 . . . . 0.0 112.444 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 95.0 p -99.77 -16.61 18.04 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.99 136.97 52.98 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.25 0.477 . . . . 0.0 111.013 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 94.8 p -83.63 -0.5 50.84 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.113 0.965 . . . . 0.0 111.634 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.265 4.0 t80 -131.24 149.16 52.69 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -155.27 150.47 26.96 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -177.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.285 0.3 OUTLIER -129.89 140.94 50.88 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 178.149 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.48 7.52 10.1 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 39.3 t -65.34 -19.62 66.04 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.983 0.513 . . . . 0.0 111.764 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -113.91 2.26 15.01 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.126 0.57 . . . . 0.0 111.539 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.1 t -80.74 151.96 28.58 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.67 0.388 . . . . 0.0 111.349 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -81.64 -13.41 57.97 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.705 0.402 . . . . 0.0 111.191 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -59.52 -23.53 62.89 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -57.35 113.1 1.61 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.25 0.62 . . . . 0.0 109.775 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -75.32 -29.73 60.11 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.31 64.7 m-85 -98.0 15.03 25.31 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 43.8 t -71.34 -18.36 62.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' THR . . . . . 0.41 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.65 151.36 78.01 Favored Pre-proline 0 C--O 1.233 0.216 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.3 Cg_exo -64.26 -32.51 62.03 Favored 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.345 2.697 . . . . 0.0 112.667 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -78.68 -27.33 45.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.115 0.416 . . . . 0.0 110.496 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -74.44 -41.13 61.37 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 174.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -63.43 -17.06 62.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.35 -0.218 . . . . 0.0 111.386 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -87.16 -10.54 52.43 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -124.02 -10.17 7.66 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -63.83 155.67 29.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -152.61 146.26 25.05 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 44.7 mm -123.21 149.32 26.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 C-N-CA 123.505 0.722 . . . . 0.0 109.516 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -156.02 155.95 33.58 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.823 0.449 . . . . 0.0 109.852 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -59.8 156.94 31.67 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.917 0.487 . . . . 0.0 109.906 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -62.91 142.67 89.25 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.182 1.922 . . . . 0.0 108.905 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.6 t -154.5 167.07 31.28 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.915 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -83.68 -2.54 56.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.802 0.441 . . . . 0.0 110.718 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.33 140.13 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.503 0.721 . . . . 0.0 112.403 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.9 mt -128.85 156.47 43.59 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.065 0.546 . . . . 0.0 110.118 176.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -115.65 150.23 37.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -137.46 154.98 49.82 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -151.57 166.83 29.97 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 102.959 -2.978 . . . . 0.0 102.959 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 56.55 57.53 4.78 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.003 -0.436 . . . . 0.0 111.663 -174.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -133.0 148.92 71.33 Favored Pre-proline 0 N--CA 1.454 -0.248 0 C-N-CA 122.427 0.291 . . . . 0.0 110.61 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.42 161.06 47.38 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.003 2.468 . . . . 0.0 110.917 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.61 -16.38 63.83 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.485 0.314 . . . . 0.0 111.008 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -100.44 12.18 37.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.404 0.682 . . . . 0.0 111.532 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.33 -18.22 23.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.586 HG23 ' H ' ' A' ' 511' ' ' GLU . 1.1 m -55.07 -177.27 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.811 -1.09 . . . . 0.0 113.686 -166.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.586 ' H ' HG23 ' A' ' 510' ' ' THR . 23.4 pt-20 -23.09 -41.18 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -169.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.7 mt-10 -57.86 -47.22 83.35 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 173.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -88.04 -27.91 21.7 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 122.356 2.343 . . . . 0.0 106.296 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.33 -37.27 86.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -75.27 -42.23 55.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.65 -24.22 49.49 Favored 'General case' 0 CA--C 1.526 0.024 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.222 -177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.04 -41.7 52.45 Favored 'Isoleucine or valine' 0 C--N 1.337 0.052 0 CA-C-N 118.864 0.756 . . . . 0.0 109.984 176.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 99.7 m -65.98 -26.99 67.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.056 -0.403 . . . . 0.0 110.853 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -70.17 -41.31 73.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -71.35 -24.46 62.1 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -89.24 -5.96 57.21 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.313 0.245 . . . . 0.0 111.212 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 69.19 -7.45 3.35 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 123.702 0.668 . . . . 0.0 113.867 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.4 m -83.9 172.83 1.0 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-N 118.459 1.129 . . . . 0.0 113.33 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.8 152.05 32.53 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.292 1.037 . . . . 0.0 113.077 -174.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 47.3 mtm105 -95.59 149.92 36.75 Favored Pre-proline 0 CA--C 1.529 0.141 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.828 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -69.74 150.29 68.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.137 2.558 . . . . 0.0 110.658 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -92.19 -14.11 29.55 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.6 t -152.58 155.52 37.53 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.358 0.263 . . . . 0.0 110.716 176.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 61.0 t -145.3 145.68 20.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 123.688 0.795 . . . . 0.0 111.31 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -147.36 142.34 26.98 Favored 'General case' 0 CA--C 1.526 0.056 0 C-N-CA 123.894 0.877 . . . . 0.0 109.334 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.69 143.03 31.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 122.981 0.513 . . . . 0.0 111.218 -176.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.1 p90 -155.67 -178.31 7.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 69.9 m -131.42 177.69 7.3 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 110.858 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.95 -5.78 59.76 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.792 0.711 . . . . 0.0 112.689 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -93.22 -20.34 20.54 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-N 117.886 0.843 . . . . 0.0 111.167 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 36.9 t -164.45 155.27 15.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.23 0.612 . . . . 0.0 110.432 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.98 -7.93 31.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.463 0.305 . . . . 0.0 110.517 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -89.23 -31.52 17.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.5 p -160.83 168.53 24.52 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.458 0.646 . . . . 0.0 112.287 -172.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 29.8 t -81.36 167.22 19.71 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.611 1.164 . . . . 0.0 111.379 178.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -146.72 159.74 43.1 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 124.373 1.069 . . . . 0.0 109.518 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.99 -173.82 45.7 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.84 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -119.27 159.76 23.48 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.413 0.685 . . . . 0.0 110.693 -177.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.7 mt -140.61 159.26 42.58 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.081 1.352 . . . . 0.0 108.414 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.99 149.1 29.18 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.979 -0.451 . . . . 0.0 111.183 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -124.04 171.0 10.1 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 125.027 1.331 . . . . 0.0 112.479 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -73.63 -12.66 60.81 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.803 0.441 . . . . 0.0 111.487 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.7 t -157.19 160.15 38.43 Favored 'General case' 0 C--N 1.339 0.115 0 O-C-N 121.687 -0.633 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.84 -29.89 68.31 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.201 0.2 . . . . 0.0 110.822 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 89.7 p -76.4 -26.01 55.14 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -74.85 -35.42 62.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.336 0.255 . . . . 0.0 110.932 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.04 -37.18 66.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.17 -37.66 78.3 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.236 -0.29 . . . . 0.0 110.247 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -62.0 -45.71 92.42 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.093 0.473 . . . . 0.0 110.264 176.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.6 m -69.9 -28.18 65.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.09 -35.7 81.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.14 -44.82 90.36 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.464 -0.631 . . . . 0.0 111.888 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -89.65 -24.6 21.6 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.33 -18.62 20.63 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -173.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.38 152.36 39.56 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.621 -0.674 . . . . 0.0 110.428 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.49 17.28 4.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.023 1.329 . . . . 0.0 113.182 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -69.75 139.3 53.31 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -75.85 138.9 41.41 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.863 -0.523 . . . . 0.0 111.945 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.3 mtm -83.49 152.66 24.82 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.125 0.488 . . . . 0.0 111.624 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 25.61 2.48 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.175 0.99 . . . . 0.0 113.062 -178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 -56.24 112.21 4.12 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 118.279 0.49 . . . . 0.0 111.704 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -82.35 -18.9 6.88 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.482 2.788 . . . . 0.0 112.123 -177.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -83.95 -12.82 54.78 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -96.28 156.09 21.16 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.588 -0.605 . . . . 0.0 111.588 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -70.68 -22.71 27.51 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 124.177 3.251 . . . . 0.0 110.583 176.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -153.13 156.27 32.51 Favored Pre-proline 0 N--CA 1.453 -0.297 0 C-N-CA 124.712 1.205 . . . . 0.0 113.933 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 159.77 52.18 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.601 2.201 . . . . 0.0 111.348 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . 0.421 ' CE2' ' C5 ' ' C' ' 1' ' ' ' A' . 6.0 m-85 -129.39 142.29 50.84 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 102.542 -3.133 . . . . 0.0 102.542 176.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.276 0.7 OUTLIER -78.15 138.53 38.76 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -176.029 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.47 150.79 25.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.977 1.311 . . . . 0.0 108.203 172.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.536 ' HB2' ' HZ2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -140.06 152.78 46.47 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.986 -177.71 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 10.8 mt -132.27 164.91 25.37 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.822 0.849 . . . . 0.0 111.144 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . 0.552 ' HG ' ' HB2' ' A' ' 402' ' ' LEU . 47.6 t -159.17 154.42 25.42 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.742 0.817 . . . . 0.0 109.21 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -59.93 117.06 4.61 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 174.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.479 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 40.3 t -73.0 146.95 45.6 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -169.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -112.32 10.82 19.99 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 169.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.3 162.54 17.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.619 0.768 . . . . 0.0 111.321 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -86.17 -3.8 59.04 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.727 -175.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -176.24 178.07 1.44 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.674 1.19 . . . . 0.0 109.576 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -133.23 16.62 4.1 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.866 0.467 . . . . 0.0 111.682 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.261 179.718 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.763 0 O4'-C1'-N19 111.863 3.663 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.873 0 C5'-C4'-C3' 110.841 -3.106 . 0.317 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.536 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C3'-C2'-C1' 104.972 3.857 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . 0.652 " H3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.925 1 P-O3'-C3' 125.367 4.722 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.891 1 O4'-C1'-N19 112.34 4.14 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.541 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.897 0 C3'-C2'-C1' 104.844 3.715 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C5'-C4'-C3' 110.717 -3.189 . 0.01 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.981 0 C3'-C2'-C1' 104.772 3.635 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.479 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 111.8 3.6 . 0.177 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 1 C5'-C4'-C3' 107.654 -5.231 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.306 37.1 t80 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 159.63 170.69 24.51 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -60.1 159.06 27.42 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 124.042 3.161 . . . . 0.0 111.598 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -155.9 153.68 30.04 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.027 0.442 . . . . 0.0 111.09 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.22 163.4 25.81 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.142 0.577 . . . . 0.0 111.185 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -74.09 -7.11 51.37 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.6 t -159.05 148.26 14.55 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.495 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . 0.417 ' HA ' ' HB3' ' A' ' 425' ' ' ASP . 74.2 Cg_endo -67.61 -14.56 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.349 2.7 . . . . 0.0 110.737 173.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.61 149.84 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -137.24 152.95 50.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.792 1.237 . . . . 0.0 108.225 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -133.96 133.44 41.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.398 -0.189 . . . . 0.0 110.512 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -129.91 152.04 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.086 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.44 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 4.8 m-85 -140.74 173.13 11.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 -177.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.72 10.71 78.69 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.437 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.6 mt -80.69 25.13 0.44 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.464 0.705 . . . . 0.0 112.201 -178.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -65.38 -39.87 92.78 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -175.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -67.28 149.66 50.08 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.133 0.492 . . . . 0.0 111.143 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 88.0 p -68.26 -8.63 41.07 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -77.71 -20.37 53.67 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 118.116 0.416 . . . . 0.0 111.182 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 64.9 mmm -82.06 147.87 28.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 122.178 -0.326 . . . . 0.0 110.252 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.07 155.78 25.8 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -60.71 -30.5 70.0 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -71.81 -40.03 69.44 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 61.0 mtt85 -76.05 -41.12 51.72 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 -175.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.58 -43.66 77.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -176.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -76.83 -29.54 55.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.429 -0.796 . . . . 0.0 109.198 -169.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -78.84 -30.21 45.08 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 119.991 1.269 . . . . 0.0 110.0 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -54.77 29.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.557 2.4 p90 -76.72 -7.34 55.17 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 172.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.7 t -69.28 -26.39 64.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 78.8 mt -54.4 -24.36 19.48 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -92.94 -11.07 34.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -173.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 170.68 176.87 40.32 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 118.205 0.457 . . . . 0.0 112.199 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -68.61 136.28 52.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.853 0.359 . . . . 0.0 111.683 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.06 165.52 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -119.97 -70.96 0.76 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.449 0.3 . . . . 0.0 111.238 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -154.44 170.68 20.81 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 9.2 p -146.03 149.37 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.369 1.068 . . . . 0.0 110.513 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -155.8 137.86 14.58 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.353 0.661 . . . . 0.0 111.075 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.4 m-85 -88.23 156.53 19.17 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 21.9 mmt -98.38 118.86 36.0 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 122.879 0.472 . . . . 0.0 111.882 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -14.42 59.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.148 0.179 . . . . 0.0 110.686 169.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 98.9 p -84.23 1.3 45.25 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.752 0.821 . . . . 0.0 112.377 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.422 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.4 mmtm -139.38 155.66 72.03 Favored Pre-proline 0 CA--C 1.528 0.115 0 C-N-CA 123.665 0.786 . . . . 0.0 110.134 -177.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -68.34 -16.08 43.15 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.174 2.583 . . . . 0.0 111.647 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.77 93.77 0.09 OUTLIER Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.41 161.55 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.467 0.707 . . . . 0.0 109.329 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.49 151.25 25.91 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.129 0.49 . . . . 0.0 111.958 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 36.8 ttm -96.11 147.29 23.88 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.6 t -141.17 152.46 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -138.56 133.69 32.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 42.6 mtp -152.36 174.17 14.16 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.346 1.058 . . . . 0.0 109.053 -171.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.85 124.25 21.97 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . 0.417 ' HB3' ' HA ' ' A' ' 379' ' ' PRO . 8.5 p30 -72.53 -32.26 65.96 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.744 -1.222 . . . . 0.0 114.164 -166.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.07 -90.84 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 O-C-N 124.559 1.162 . . . . 0.0 110.775 -176.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.296 64.7 m-85 -75.85 -20.24 58.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.2 -33.99 15.98 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 118.569 -1.253 . . . . 0.0 111.371 -175.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.6 t -86.97 -26.96 5.89 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 C-N-CA 118.238 -1.385 . . . . 0.0 109.057 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -67.5 -51.37 52.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.651 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -65.49 -35.83 82.06 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.965 -0.46 . . . . 0.0 112.111 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.29 83.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.604 0.638 . . . . 0.0 110.417 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.5 mt -77.13 -14.15 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 122.848 0.459 . . . . 0.0 110.899 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 15.5 m -94.7 -19.78 20.11 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 114.452 1.279 . . . . 0.0 114.452 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -126.07 -27.99 3.21 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.9 mt -134.38 -8.94 2.55 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -172.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.56 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -70.27 105.32 2.94 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -168.365 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.552 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 15.3 m-80 75.15 22.08 1.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 116.788 -3.695 . . . . 0.0 115.055 -164.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -77.36 161.45 28.03 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.307 -0.871 . . . . 0.0 109.707 167.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -79.62 138.37 37.4 Favored 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 177.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.2 ttt -159.51 136.95 9.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.289 0.636 . . . . 0.0 110.174 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.389 52.0 m-85 57.32 26.65 12.66 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.02 9.79 86.69 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.261 -0.735 . . . . 0.0 111.261 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -135.84 -164.67 1.58 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.019 1.328 . . . . 0.0 108.779 -178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.46 147.22 52.13 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.698 0.285 . . . . 0.0 111.33 -176.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.5 ptm -118.57 75.6 1.03 Allowed 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 124.477 1.111 . . . . 0.0 109.171 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.552 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.3 m120 -53.7 127.19 24.71 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 115.979 -1.963 . . . . 0.0 112.265 -173.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.56 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.2 t -126.71 152.06 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 113.537 -3.265 . . . . 0.0 115.877 169.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 43.2 t -160.74 165.74 29.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.523 1.529 . . . . 0.0 108.324 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.14 147.93 11.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 O-C-N 121.56 -0.713 . . . . 0.0 112.56 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.4 t -88.14 157.72 18.75 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 122.827 0.451 . . . . 0.0 111.35 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -97.55 -5.66 35.26 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.087 0.155 . . . . 0.0 110.652 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -77.84 152.57 80.2 Favored Pre-proline 0 N--CA 1.456 -0.153 0 C-N-CA 123.546 0.739 . . . . 0.0 111.029 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.56 -36.06 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.363 2.709 . . . . 0.0 112.139 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.99 159.69 9.5 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.358 0.663 . . . . 0.0 110.707 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.23 132.41 32.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 37.0 mmm -100.33 126.24 36.76 Favored Pre-proline 0 N--CA 1.454 -0.24 0 C-N-CA 122.454 0.301 . . . . 0.0 110.707 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.62 153.79 44.03 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.186 2.591 . . . . 0.0 109.102 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 167.81 -127.8 1.62 Allowed Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.86 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -72.45 172.95 9.51 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.1 p -156.36 172.3 18.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.044 0.538 . . . . 0.0 110.215 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -137.16 4.44 2.7 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.0 -176.2 53.93 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 56.0 mt -145.65 168.76 19.9 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.053 0.941 . . . . 0.0 109.916 -178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . 0.401 ' H ' ' CD ' ' A' ' 465' ' ' GLU . 2.4 pm0 -65.3 -31.38 72.49 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.065 0.546 . . . . 0.0 110.364 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -120.5 10.02 11.04 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.47 172.82 30.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.739 -0.545 . . . . 0.0 111.739 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 92.0 p -101.72 -15.03 17.11 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 122.89 0.476 . . . . 0.0 111.997 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.11 145.69 50.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.864 0.465 . . . . 0.0 110.171 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 78.6 p -85.49 10.4 13.1 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.396 0.678 . . . . 0.0 111.301 177.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -138.18 149.9 46.26 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.29 150.98 30.35 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 120.801 0.334 . . . . 0.0 110.485 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -124.09 138.37 54.44 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.156 0.983 . . . . 0.0 113.577 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.23 2.53 5.18 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 95.9 p -66.11 -15.91 63.5 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.123 0.569 . . . . 0.0 112.158 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -113.98 -0.38 14.1 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.05 0.54 . . . . 0.0 111.369 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 68.6 m -79.84 150.83 30.54 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.599 0.36 . . . . 0.0 111.522 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -79.47 -12.56 59.88 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.987 0.515 . . . . 0.0 111.193 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.18 -18.99 62.62 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -176.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -61.75 115.04 3.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -73.06 -31.52 64.45 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.447 0.299 . . . . 0.0 111.59 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.29 61.1 m-85 -97.93 17.4 18.31 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 42.6 t -64.43 -20.9 66.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.86 151.39 70.28 Favored Pre-proline 0 C--O 1.231 0.129 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.59 27.01 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.111 2.541 . . . . 0.0 111.923 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -80.13 -20.15 45.61 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.255 0.48 . . . . 0.0 110.705 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -85.73 -39.7 16.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 172.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.96 64.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.761 0.424 . . . . 0.0 111.996 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.27 -21.36 53.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -124.08 7.74 8.59 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.03 156.63 38.32 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.453 0.57 . . . . 0.0 111.913 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -118.6 146.47 44.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.553 0.741 . . . . 0.0 110.728 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.3 mm -143.57 138.29 25.64 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.21 159.3 35.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -58.81 154.91 34.24 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -65.16 146.57 87.04 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.32 2.013 . . . . 0.0 109.073 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -155.95 170.95 20.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.309 0.244 . . . . 0.0 110.636 -173.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -83.7 -1.19 53.56 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.569 0.348 . . . . 0.0 111.034 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.77 137.57 29.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.5 mt -123.32 161.48 24.58 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.232 0.613 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -130.17 143.76 50.97 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.736 1.214 . . . . 0.0 108.316 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.86 163.24 30.69 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.445 0.64 . . . . 0.0 112.067 -177.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -149.31 162.53 39.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 57.1 57.36 4.61 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.736 0.414 . . . . 0.0 111.727 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -121.64 151.27 56.82 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 122.686 0.394 . . . . 0.0 111.989 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.84 152.61 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.585 2.857 . . . . 0.0 112.921 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.61 -16.43 63.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.173 0.589 . . . . 0.0 111.444 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -123.05 25.62 8.44 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.394 0.677 . . . . 0.0 110.696 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.79 -12.59 14.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.57 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.91 -177.31 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.865 -1.065 . . . . 0.0 113.854 -165.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.57 ' H ' HG21 ' A' ' 510' ' ' THR . 22.9 pt-20 -26.46 -37.27 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -169.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.3 mt-10 -58.22 -47.38 83.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 117.07 -1.443 . . . . 0.0 114.559 171.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -88.19 -26.7 22.26 Favored 'General case' 0 C--N 1.353 0.718 0 CA-C-N 122.732 2.514 . . . . 0.0 107.113 -173.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -67.63 -34.49 77.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.503 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -75.2 -42.86 54.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -76.19 -21.34 56.58 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.802 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.96 -40.6 26.86 Favored 'Isoleucine or valine' 0 C--N 1.339 0.113 0 CA-C-N 118.423 0.556 . . . . 0.0 109.954 175.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 87.7 m -68.4 -34.59 76.31 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.958 -0.464 . . . . 0.0 110.933 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.16 -38.1 84.88 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -70.54 -28.39 64.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 122.114 -0.366 . . . . 0.0 111.032 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -92.51 -4.12 54.07 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.263 0.625 . . . . 0.0 111.519 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.58 -2.0 59.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.15 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.0 t -77.1 153.55 5.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 118.072 0.936 . . . . 0.0 112.182 178.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -68.36 151.68 46.52 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.399 . . . . 0.0 110.294 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.9 ptt85 -78.07 156.14 79.56 Favored Pre-proline 0 CA--C 1.53 0.2 0 C-N-CA 122.685 0.394 . . . . 0.0 110.365 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.06 154.29 72.93 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.111 2.541 . . . . 0.0 110.386 173.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.3 t -85.39 -17.28 37.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.1 t -156.97 152.72 27.0 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.558 0.343 . . . . 0.0 110.173 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.1 m -143.44 154.73 16.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 123.719 0.808 . . . . 0.0 112.35 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -150.75 144.33 25.05 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.181 0.592 . . . . 0.0 109.973 176.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -138.08 150.73 24.85 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 C-N-CA 123.398 0.679 . . . . 0.0 112.218 177.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -152.83 174.84 13.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.7 t -142.96 168.91 18.59 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.556 0.742 . . . . 0.0 109.624 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 115.15 -16.47 17.74 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 123.857 0.741 . . . . 0.0 111.985 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -80.91 -26.48 36.74 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 117.795 0.797 . . . . 0.0 111.131 175.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.2 t -163.9 157.35 18.58 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.747 0.819 . . . . 0.0 109.686 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -96.99 -6.89 34.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.539 0.336 . . . . 0.0 110.532 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -78.18 -41.54 34.33 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 32.5 t -161.13 163.56 31.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -170.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -90.36 167.32 12.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.096 0.958 . . . . 0.0 111.702 -177.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.3 m -145.44 165.66 27.91 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 124.996 1.318 . . . . 0.0 108.748 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.69 -170.77 43.92 Favored Glycine 0 CA--C 1.525 0.701 0 C-N-CA 120.554 -0.832 . . . . 0.0 113.322 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.03 159.84 26.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.036 0.934 . . . . 0.0 110.228 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.51 156.91 45.7 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 124.588 1.155 . . . . 0.0 109.085 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -148.18 149.38 31.87 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 117.925 0.33 . . . . 0.0 111.664 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.0 m-90 -126.81 172.53 10.3 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 124.828 1.251 . . . . 0.0 112.152 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -76.13 -9.59 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.666 0.386 . . . . 0.0 110.556 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.9 t -158.4 158.93 35.15 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.623 -0.673 . . . . 0.0 111.669 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -69.45 -24.9 63.87 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 122.368 0.267 . . . . 0.0 110.502 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 49.2 m -77.91 -27.49 49.53 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -74.31 -32.15 62.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -77.83 -25.91 49.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.7 tp -77.38 -37.16 52.66 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.199 0.199 . . . . 0.0 111.317 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -75.61 -38.54 58.92 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.591 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.264 0.2 OUTLIER -71.6 -22.28 61.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 12.1 tp -67.91 -37.44 81.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 170.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.11 -30.46 76.93 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.315 11.5 m-85 -101.32 -2.57 30.72 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 84.6 mt -125.05 -3.63 7.56 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.287 0.948 . . . . 0.0 113.29 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -79.88 139.58 37.08 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.739 1.154 . . . . 0.0 109.586 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 56.74 19.37 4.32 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 175.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -77.86 149.96 34.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 104.103 -2.555 . . . . 0.0 104.103 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -78.34 143.38 36.96 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.719 0.408 . . . . 0.0 111.992 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.1 mtm -83.57 152.65 24.75 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 111.259 175.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -81.33 38.67 0.49 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.138 0.975 . . . . 0.0 111.295 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -47.0 109.94 1.17 Allowed Pre-proline 0 CA--C 1.533 0.297 0 C-N-CA 123.893 0.877 . . . . 0.0 112.734 -171.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -86.42 -12.93 5.36 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.824 3.016 . . . . 0.0 111.682 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -84.48 -0.17 51.94 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -173.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -159.78 170.21 35.92 Favored Glycine 0 CA--C 1.526 0.772 0 CA-C-N 118.31 0.505 . . . . 0.0 112.327 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.2 -10.73 24.56 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.952 3.768 . . . . 0.0 112.232 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.254 0.8 OUTLIER -140.6 149.38 56.82 Favored Pre-proline 0 N--CA 1.454 -0.267 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -77.58 164.22 28.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 123.751 2.967 . . . . 0.0 111.675 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -129.93 142.29 50.67 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 172.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.02 141.96 32.76 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -82.3 146.1 29.61 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 172.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.513 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.2 OUTLIER -135.14 148.48 49.76 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 117.829 0.286 . . . . 0.0 110.237 -179.469 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.3 pp -154.99 165.46 36.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.181 0.515 . . . . 0.0 111.811 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 31.3 p -159.8 174.42 14.51 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.971 0.908 . . . . 0.0 109.887 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -61.04 126.43 27.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.4 t -84.29 156.09 22.11 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -172.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -122.08 11.78 10.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.317 1.047 . . . . 0.0 113.604 170.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.58 162.92 14.59 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.087 0.955 . . . . 0.0 111.659 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -85.73 -3.23 58.84 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.65 178.21 3.18 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.027 0.931 . . . . 0.0 109.359 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -132.41 16.43 4.47 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.987 0.515 . . . . 0.0 111.465 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.614 -1.184 . . . . 0.0 110.492 -179.861 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.44 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.762 1 O4'-C1'-N19 112.236 4.036 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 C5'-C4'-C3' 110.314 -3.457 . 0.373 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.569 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.944 0 C3'-C2'-C1' 104.557 3.397 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 1 C5'-C4'-C3' 108.971 -4.353 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.898 1 O4'-C1'-N19 112.754 4.554 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.492 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.752 0 C5'-C4'-C3' 109.632 -3.912 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C5'-C4'-C3' 111.441 -2.706 . 0.08 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.926 0 C3'-C2'-C1' 104.645 3.495 . 0.055 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 O4'-C1'-N19 111.657 3.457 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.629 1 C5'-C4'-C3' 108.397 -4.735 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.303 35.7 t80 . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -73.73 167.81 54.29 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.31 176.79 6.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.369 3.38 . . . . 0.0 110.816 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -146.33 158.32 43.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.819 0.448 . . . . 0.0 110.539 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.41 160.65 31.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.623 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -78.95 -3.43 44.89 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.379 0.672 . . . . 0.0 110.576 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -155.12 148.64 18.61 Favored Pre-proline 0 C--O 1.233 0.21 0 O-C-N 121.726 -0.609 . . . . 0.0 112.058 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -61.33 -5.84 5.89 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 124.246 3.297 . . . . 0.0 113.029 172.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 153.33 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.091 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.7 tt -128.07 154.49 45.64 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.655 1.582 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.9 tpt -137.4 133.55 34.9 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 117.847 0.294 . . . . 0.0 110.971 -175.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.54 153.44 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.444 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 2.5 m-85 -146.12 170.48 16.61 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 87.72 6.94 75.83 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.669 -0.517 . . . . 0.0 113.07 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.05 45.28 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.106 0.962 . . . . 0.0 111.372 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -82.04 -13.47 57.29 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -174.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -83.76 147.14 27.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.672 0.389 . . . . 0.0 110.176 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 91.1 p -72.67 -7.32 49.81 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -81.47 -17.4 48.85 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.651 0.38 . . . . 0.0 111.353 -177.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 92.5 mmm -83.66 162.63 20.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.351 0.596 . . . . 0.0 111.487 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -167.74 168.76 12.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.612 1.565 . . . . 0.0 106.79 176.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -61.67 -34.25 75.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.379 0.536 . . . . 0.0 110.95 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -74.74 -29.51 61.19 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -74.23 -51.54 15.09 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 122.127 -0.358 . . . . 0.0 111.052 -175.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.7 p -72.6 -37.61 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -73.37 -32.06 64.29 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.13 -48.37 80.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 118.897 0.771 . . . . 0.0 111.403 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 31.0 t -56.69 -55.63 18.63 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 1.4 p90 -76.52 -5.8 49.11 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 29.0 t -77.4 -34.05 54.9 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.699 -0.626 . . . . 0.0 111.657 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.66 -12.23 22.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 119.916 -0.714 . . . . 0.0 111.597 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.81 2.77 40.8 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 169.94 -144.38 8.48 Favored Glycine 0 CA--C 1.525 0.688 0 O-C-N 121.805 -0.559 . . . . 0.0 112.008 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -116.17 131.65 56.88 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.9 m -113.94 165.59 8.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -175.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -118.42 -65.95 1.12 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.563 0.345 . . . . 0.0 111.662 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . 0.439 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 36.2 mtmm -150.57 169.3 21.87 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.325 0.511 . . . . 0.0 111.914 -173.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.9 p -146.78 147.83 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 123.95 0.9 . . . . 0.0 109.264 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -154.63 140.74 18.44 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.582 0.353 . . . . 0.0 111.118 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.281 5.2 m-85 -94.44 156.52 16.44 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 117.052 2.242 . . . . 0.0 117.052 -178.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.4 mmt -93.75 125.17 38.22 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.008 0.523 . . . . 0.0 112.234 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . 0.437 ' HE2' " H5'" ' B' ' 4' ' ' ' C' . 0.2 OUTLIER -79.12 -14.32 59.2 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 124.311 1.044 . . . . 0.0 111.802 176.803 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 90.4 p -97.18 1.25 49.59 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.364 0.666 . . . . 0.0 112.483 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.429 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 46.7 mmtm -131.44 152.81 81.15 Favored Pre-proline 0 CA--C 1.53 0.196 0 C-N-CA 123.165 0.586 . . . . 0.0 110.293 -175.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -71.07 -14.68 32.08 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.303 2.669 . . . . 0.0 111.737 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.21 90.81 0.08 OUTLIER Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.63 156.23 37.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.91 154.01 29.06 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.945 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.2 ptm -107.64 150.01 27.4 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 9.4 t -141.18 130.33 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -173.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -107.18 131.93 53.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 47.6 mtp -153.29 171.29 18.79 Favored 'General case' 0 C--O 1.231 0.092 0 C-N-CA 123.211 0.605 . . . . 0.0 109.377 -172.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.79 115.89 6.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -72.35 -33.44 67.27 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.78 -87.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -75.07 -25.56 58.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -175.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.35 -36.09 16.8 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.053 -174.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.57 -26.45 6.5 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.042 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -64.43 -53.4 49.01 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 117.981 0.355 . . . . 0.0 111.947 173.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -69.91 -29.18 66.29 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.01 80.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.599 0.636 . . . . 0.0 110.144 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.0 mt -78.6 -15.44 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.147 0.579 . . . . 0.0 110.73 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 45.3 m -91.37 -20.82 21.42 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.55 -24.35 2.01 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -128.91 -12.14 4.75 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.731 1.605 . . . . 0.0 113.78 -172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.524 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.79 101.07 2.51 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -168.468 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.552 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 17.3 m-80 78.85 21.82 0.69 Allowed 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 123.643 2.928 . . . . 0.0 113.639 -160.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -81.09 157.85 25.24 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.469 -0.769 . . . . 0.0 109.073 167.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -78.58 139.05 38.64 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.9 ttt -154.17 133.96 12.98 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.404 ' CZ ' ' CD1' ' A' ' 558' ' ' PHE 0.356 53.5 m-85 56.69 22.6 6.98 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 -176.509 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.81 11.03 66.19 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.741 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -146.38 146.4 30.62 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 117.775 0.788 . . . . 0.0 111.002 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -77.61 149.95 34.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.996 0.518 . . . . 0.0 111.361 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.1 ptt? -131.48 83.67 2.12 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.494 0.717 . . . . 0.0 109.281 176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.552 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 28.9 t-20 -54.66 129.26 35.96 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.163 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.524 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.461 2.1 t -123.79 150.61 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 113.118 -3.433 . . . . 0.0 115.953 168.417 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 33.8 t -160.82 172.01 17.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.538 1.135 . . . . 0.0 108.211 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -73.23 147.19 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.6 t -86.78 155.68 20.22 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.226 0.61 . . . . 0.0 111.491 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -92.88 -7.53 45.96 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -77.58 145.7 71.91 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.049 0.94 . . . . 0.0 110.34 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.7 -33.87 2.11 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.019 2.48 . . . . 0.0 111.388 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.91 161.66 10.89 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.439 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 64.5 mt -83.61 129.03 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 mmm -91.93 122.41 65.29 Favored Pre-proline 0 N--CA 1.454 -0.257 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 174.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.81 144.02 47.35 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.665 2.243 . . . . 0.0 108.827 174.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 169.69 -134.56 3.22 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.582 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -72.55 160.9 31.52 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.371 0.669 . . . . 0.0 111.369 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.3 p -145.03 171.94 13.77 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.461 1.104 . . . . 0.0 109.546 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -133.65 -0.49 3.18 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.35 179.78 51.14 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 112.172 -0.371 . . . . 0.0 112.172 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 81.9 mt -143.37 154.19 43.48 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.864 0.866 . . . . 0.0 109.25 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -75.26 -4.08 36.97 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.447 0.299 . . . . 0.0 110.98 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -120.43 11.11 11.34 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.223 1.009 . . . . 0.0 113.698 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -163.74 -144.84 4.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.056 -1.218 . . . . 0.0 110.056 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 97.6 p -133.0 -24.52 1.89 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.269 0.534 . . . . 0.0 112.138 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.2 t -127.06 149.73 49.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.754 0.421 . . . . 0.0 110.286 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.2 p -91.7 9.89 30.57 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.28 0.632 . . . . 0.0 110.856 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -143.92 150.9 39.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -155.22 157.68 37.7 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.606 0.241 . . . . 0.0 110.363 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -133.31 133.69 42.88 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -176.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.64 1.43 9.46 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.7 p -72.86 -6.91 48.15 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.545 0.738 . . . . 0.0 111.314 -179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -113.95 16.79 18.23 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.885 0.874 . . . . 0.0 111.528 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -139.03 150.92 46.35 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.87 6.48 41.69 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.909 0.884 . . . . 0.0 112.185 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -63.5 -25.72 68.39 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -67.32 150.37 49.1 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -69.9 -33.78 72.65 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.337 -0.545 . . . . 0.0 112.071 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.418 56.6 m-85 -98.08 10.19 41.04 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 177.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.4 t -69.24 -21.66 63.91 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -171.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -133.3 150.86 76.4 Favored Pre-proline 0 CA--C 1.529 0.145 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.53 -23.5 27.22 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.168 2.579 . . . . 0.0 112.0 -177.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -73.76 -24.11 59.82 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.452 0.569 . . . . 0.0 110.217 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -83.21 -52.72 6.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 174.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.25 -20.39 64.19 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.762 0.825 . . . . 0.0 112.622 -171.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.51 60.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 117.943 0.338 . . . . 0.0 111.634 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -124.03 6.65 8.59 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.61 155.44 15.52 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.492 0.587 . . . . 0.0 112.233 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.422 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 13.4 ptp180 -152.98 147.23 25.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.0 mm -136.61 151.45 28.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 C-N-CA 123.379 0.671 . . . . 0.0 109.734 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -155.99 158.02 37.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -61.84 154.94 64.92 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -62.39 144.06 94.44 Favored 'Trans proline' 0 N--CA 1.449 -1.096 0 C-N-CA 122.811 2.341 . . . . 0.0 109.909 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.9 t -153.45 -179.99 8.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -83.73 0.01 48.98 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.989 -0.444 . . . . 0.0 110.802 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.0 t -100.18 137.24 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.3 mt -125.59 159.81 31.19 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 109.134 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -128.81 147.03 50.76 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -133.52 159.89 39.07 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -150.62 163.57 38.19 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 56.93 43.49 24.63 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.154 -0.341 . . . . 0.0 111.537 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.52 150.8 39.44 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.13 153.46 32.71 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.448 2.765 . . . . 0.0 112.673 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.55 -16.52 63.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.079 0.552 . . . . 0.0 111.581 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -122.95 24.07 9.11 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.514 0.726 . . . . 0.0 110.98 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.8 p -64.29 -13.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.581 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.76 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -165.836 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.581 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -25.55 -37.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -169.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.1 mt-10 -58.37 -48.69 79.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 117.244 -1.36 . . . . 0.0 114.22 171.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -86.21 -27.16 24.67 Favored 'General case' 0 C--N 1.352 0.68 0 CA-C-N 122.407 2.367 . . . . 0.0 106.747 -173.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -64.57 -39.81 94.41 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -71.97 -42.45 66.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.35 -26.85 56.15 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.042 -1.063 . . . . 0.0 111.155 -177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.9 mt -70.55 -39.61 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 CA-C-N 118.825 0.739 . . . . 0.0 110.456 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.04 -34.16 77.45 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.012 -0.43 . . . . 0.0 110.786 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -70.77 -27.19 63.74 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -80.53 -8.55 59.62 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.354 0.261 . . . . 0.0 111.618 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.4 mt -114.91 -2.88 12.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.738 0.415 . . . . 0.0 111.578 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.28 0.35 56.96 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 119.78 -0.455 . . . . 0.0 112.271 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.0 148.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 CA-C-N 117.778 0.789 . . . . 0.0 110.851 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -69.55 145.5 52.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 120.89 0.376 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 -71.26 150.68 94.4 Favored Pre-proline 0 N--CA 1.455 -0.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.412 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.2 158.73 56.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.841 3.028 . . . . 0.0 111.095 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -90.9 -23.13 20.59 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.6 m -154.13 152.16 30.1 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.979 0.511 . . . . 0.0 111.119 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.04 156.56 19.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.76 0.824 . . . . 0.0 112.993 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -153.67 143.25 21.73 Favored 'General case' 0 C--O 1.228 -0.046 0 C-N-CA 122.918 0.487 . . . . 0.0 109.824 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.29 149.33 25.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.498 0.719 . . . . 0.0 112.207 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -156.45 -171.52 3.73 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.3 t -140.68 -176.65 4.73 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.872 0.869 . . . . 0.0 109.948 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.8 74.44 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.847 0.737 . . . . 0.0 111.967 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -96.36 -17.03 20.94 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 117.429 0.614 . . . . 0.0 111.279 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 48.3 t -164.05 151.55 12.27 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.3 0.64 . . . . 0.0 110.082 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.06 -7.77 31.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.667 0.387 . . . . 0.0 110.546 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -86.68 -33.72 19.97 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.603 0.761 . . . . 0.0 112.465 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 96.4 p -162.89 173.37 13.79 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.076 0.465 . . . . 0.0 111.48 -169.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.4 t -88.31 166.69 14.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.485 0.714 . . . . 0.0 110.934 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.1 p -149.69 162.86 39.39 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.382 1.073 . . . . 0.0 108.427 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.44 -172.79 45.67 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.572 -177.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -113.3 159.45 19.36 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.595 0.758 . . . . 0.0 110.321 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 15.0 tp -145.64 152.19 39.25 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.963 0.905 . . . . 0.0 108.726 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -150.44 148.65 29.01 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-N 119.197 0.908 . . . . 0.0 112.921 -174.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -123.47 175.73 6.6 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 125.245 1.418 . . . . 0.0 112.802 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.61 -5.38 57.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 40.7 t -158.31 155.73 29.35 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.195 0.598 . . . . 0.0 110.61 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -72.67 -24.21 60.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.521 0.328 . . . . 0.0 111.12 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.8 p -79.16 -24.12 43.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.931 0.332 . . . . 0.0 110.442 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -76.99 -31.6 56.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.424 0.29 . . . . 0.0 111.385 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.77 -28.04 58.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.34 -39.78 62.59 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.162 -0.336 . . . . 0.0 111.073 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -70.15 -36.77 74.97 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.483 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.3 m -69.79 -27.8 65.2 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.87 -38.26 90.17 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.82 -38.32 94.25 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 442' ' ' PHE 0.298 8.0 m-85 -92.44 -3.0 55.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 119.214 3.042 . . . . 0.0 119.214 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 37.4 mt -133.92 -6.71 2.75 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -69.76 143.22 53.07 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 120.46 1.482 . . . . 0.0 108.991 176.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 60.49 18.94 8.72 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.119 0.968 . . . . 0.0 113.271 178.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 34.5 t80 -70.13 135.3 49.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.51 139.32 47.53 Favored 'General case' 0 C--O 1.23 0.069 0 O-C-N 122.001 -0.437 . . . . 0.0 112.168 -174.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.52 152.45 24.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.296 175.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 10.5 ptmm? -83.65 46.26 1.14 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.839 0.856 . . . . 0.0 110.624 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -49.72 110.3 1.56 Allowed Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 123.663 0.785 . . . . 0.0 112.129 -173.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.67 -14.19 5.56 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.65 2.9 . . . . 0.0 111.474 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -90.59 6.05 45.33 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -173.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -162.2 167.76 36.94 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 118.502 0.592 . . . . 0.0 112.356 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -73.99 -10.37 22.89 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.841 3.694 . . . . 0.0 112.07 -178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -140.18 148.54 54.81 Favored Pre-proline 0 N--CA 1.455 -0.188 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.91 164.26 25.31 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 124.005 3.137 . . . . 0.0 111.792 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -129.88 142.33 50.68 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 102.006 -3.331 . . . . 0.0 102.006 171.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.274 0.6 OUTLIER -81.95 137.15 35.21 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -174.227 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -78.11 135.1 37.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.501 ' HB2' ' HZ1' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -128.49 151.19 49.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -178.703 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.2 pp -151.38 166.48 30.91 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.489 0.662 . . . . 0.0 110.962 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 45.2 t -159.81 163.0 34.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.781 0.832 . . . . 0.0 109.359 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -57.52 124.74 20.04 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 172.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.446 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 34.0 t -75.1 149.03 39.22 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -170.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.271 0.6 OUTLIER -116.86 9.67 13.92 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 170.788 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.05 163.39 22.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.204 1.002 . . . . 0.0 111.816 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -92.5 -3.05 55.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.513 -178.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -155.14 174.61 14.96 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 123.572 0.749 . . . . 0.0 110.491 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.44 18.78 1.88 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.045 0.938 . . . . 0.0 109.855 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.221 -1.371 . . . . 0.0 110.918 -177.414 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.444 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.701 1 O4'-C1'-N19 112.437 4.237 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.792 0 C5'-C4'-C3' 110.573 -3.284 . 0.453 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.422 " O3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.949 1 C3'-C2'-C1' 105.521 4.468 OUTLIER-DELTA 0.199 4b . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . 0.469 ' C6 ' H5'' ' B' ' 4' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.928 1 C5'-C4'-C3' 108.525 -4.65 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.423 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.754 1 O4'-C1'-N19 113.058 4.858 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.454 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 C3'-C2'-C1' 104.811 3.679 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . 0.457 " H1'" ' HE2' ' A' ' 576' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.861 0 O4'-C1'-N19 111.055 2.855 . 0.084 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C3'-C2'-C1' 104.466 3.296 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.446 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 O4'-C1'-N19 111.259 3.059 . 0.246 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 1 C5'-C4'-C3' 108.715 -4.523 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.28 22.1 t80 . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.75 174.76 46.88 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 111.289 -0.724 . . . . 0.0 111.289 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.9 167.05 25.73 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.308 3.339 . . . . 0.0 111.101 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -156.66 159.69 38.65 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.746 0.418 . . . . 0.0 110.721 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.15 163.26 28.22 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.781 0.433 . . . . 0.0 111.209 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -71.53 -9.59 58.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.77 148.4 12.49 Favored Pre-proline 0 CA--C 1.53 0.21 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.162 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.13 -18.73 45.55 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.554 2.836 . . . . 0.0 112.085 172.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -87.6 153.32 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.5 tt -143.08 154.04 43.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.246 1.018 . . . . 0.0 108.907 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' MET . . . . . 0.47 ' HG3' ' C2 ' ' B' ' 2' ' ' ' C' . 77.3 mmm -132.01 141.73 49.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.62 0.368 . . . . 0.0 111.292 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.11 150.6 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -141.36 173.45 11.48 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 -175.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.56 8.59 80.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.849 -0.5 . . . . 0.0 111.849 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 29.06 0.19 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.696 0.798 . . . . 0.0 112.248 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.14 -37.3 86.98 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 -67.35 149.61 50.08 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 33.8 t -70.45 -9.75 57.32 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.301 0.64 . . . . 0.0 112.582 -175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -71.4 -21.21 62.03 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 121.897 -0.502 . . . . 0.0 111.621 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 55.1 mmm -82.29 145.93 29.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.078 -0.389 . . . . 0.0 110.696 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -160.27 156.07 25.82 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.256 1.022 . . . . 0.0 108.452 177.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.8 p -59.99 -29.23 68.32 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -70.97 -42.44 69.72 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.201 0.455 . . . . 0.0 111.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -75.98 -42.7 47.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -175.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.5 t -69.45 -42.24 80.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.409 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 2.3 t80 -76.9 -32.88 57.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -169.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -74.17 -29.36 61.74 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 120.012 1.278 . . . . 0.0 109.897 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -59.67 -59.2 4.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.552 0.7 OUTLIER -76.65 -3.48 38.09 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 174.35 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . 0.443 ' HG ' HG11 ' A' ' 406' ' ' VAL . 33.1 t -74.66 -37.77 62.63 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.873 -0.517 . . . . 0.0 111.323 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.37 -16.99 51.81 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -9.81 59.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 117.118 2.266 . . . . 0.0 117.118 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -174.03 -128.99 1.13 Allowed Glycine 0 CA--C 1.525 0.666 0 O-C-N 121.903 -0.498 . . . . 0.0 112.347 -175.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -138.08 127.0 23.98 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.563 0.745 . . . . 0.0 109.035 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.443 HG11 ' HG ' ' A' ' 401' ' ' CYS . 1.0 OUTLIER -114.07 165.57 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -175.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -122.35 -57.21 1.77 Allowed 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -154.52 162.55 41.09 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -142.8 152.54 17.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 124.474 1.11 . . . . 0.0 109.793 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -157.47 140.73 15.42 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -90.17 167.56 12.62 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 ptp -142.91 133.58 25.2 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 121.359 0.599 . . . . 0.0 111.7 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -5.66 54.62 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.648 1.179 . . . . 0.0 112.338 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 83.1 p -77.74 -1.23 30.24 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -140.24 156.37 69.98 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 124.452 1.101 . . . . 0.0 109.093 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -67.15 -12.57 36.49 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.181 2.587 . . . . 0.0 111.739 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.9 97.36 0.11 Allowed Glycine 0 C--N 1.337 0.621 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.33 159.82 37.88 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.963 0.505 . . . . 0.0 110.372 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -154.54 155.67 35.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.971 0.415 . . . . 0.0 111.048 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 43.7 ttm -108.98 148.76 30.24 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.479 1.112 . . . . 0.0 109.008 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.0 t -138.7 153.26 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 123.308 0.643 . . . . 0.0 111.431 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -140.8 132.52 27.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.332 0.515 . . . . 0.0 110.797 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 9.7 ptp -162.56 176.14 10.71 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.353 1.061 . . . . 0.0 110.535 -172.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.46 120.81 12.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 174.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -72.36 -33.47 67.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.42 -86.55 0.02 OUTLIER Glycine 0 CA--C 1.517 0.172 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.264 72.9 m-85 -74.78 -25.57 59.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -86.78 -37.19 18.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.905 -175.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.3 t -82.36 -32.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.339 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -69.22 -41.02 77.58 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -68.2 -38.61 82.15 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.52 0.6 . . . . 0.0 111.844 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -64.45 -35.29 80.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.277 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 51.5 mt -77.65 -15.89 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.184 0.594 . . . . 0.0 111.177 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 28.4 m -93.67 -19.47 21.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -133.67 -20.46 2.03 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 116.558 2.059 . . . . 0.0 116.558 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.36 -12.88 2.39 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 120.795 1.634 . . . . 0.0 114.648 -172.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.521 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.47 100.96 2.32 Favored 'General case' 0 C--O 1.201 -1.471 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -168.309 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.587 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 10.9 m-80 78.63 22.05 0.72 Allowed 'General case' 0 N--CA 1.484 1.256 0 O-C-N 117.614 -3.179 . . . . 0.0 114.051 -161.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -74.16 162.8 28.59 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.428 -0.795 . . . . 0.0 109.706 167.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -80.22 142.45 34.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 172.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.6 ttt -158.64 134.28 8.81 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.352 45.6 m-85 58.39 11.04 1.5 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 97.44 3.71 58.5 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -128.96 -165.01 1.45 Allowed 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.184 0.994 . . . . 0.0 108.933 176.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -126.1 149.88 48.6 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 122.683 0.393 . . . . 0.0 111.31 -177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.2 ptm -124.62 75.57 1.42 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.231 1.012 . . . . 0.0 109.637 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.587 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.8 m120 -51.98 127.06 20.2 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 115.618 -2.134 . . . . 0.0 112.821 -174.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.521 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.439 2.1 t -126.29 152.17 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 113.21 -3.396 . . . . 0.0 115.952 169.161 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.46 167.27 17.73 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.028 1.331 . . . . 0.0 109.069 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.94 147.48 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 40.4 t -87.49 159.78 18.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.901 0.481 . . . . 0.0 111.865 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -100.5 -8.04 23.55 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.377 0.271 . . . . 0.0 110.6 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -76.79 150.54 81.67 Favored Pre-proline 0 N--CA 1.455 -0.202 0 C-N-CA 123.477 0.711 . . . . 0.0 111.104 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.99 -36.11 1.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.558 2.839 . . . . 0.0 112.178 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.37 157.68 9.24 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.198 0.599 . . . . 0.0 110.726 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.02 142.96 13.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 78.7 mtp -115.27 126.78 27.43 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 122.072 0.149 . . . . 0.0 111.346 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.88 168.28 23.76 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.79 2.994 . . . . 0.0 109.875 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.47 -135.3 4.77 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -72.33 157.35 37.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.17 0.588 . . . . 0.0 109.663 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.6 p -148.79 177.88 9.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.593 0.357 . . . . 0.0 110.72 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -122.17 4.47 9.79 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 81.98 -177.54 53.8 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 54.8 mt -144.65 168.14 20.89 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 124.057 0.943 . . . . 0.0 109.911 -178.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.3 pm0 -66.16 -31.1 71.74 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.203 0.601 . . . . 0.0 110.447 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -120.51 12.11 11.5 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -155.95 172.11 33.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 112.044 -0.423 . . . . 0.0 112.044 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.9 m -100.42 -18.39 16.74 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 10.6 p -127.13 154.31 44.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.306 0.643 . . . . 0.0 111.457 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.0 p -83.64 -3.55 57.83 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 122.777 0.431 . . . . 0.0 111.424 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.25 2.3 t80 -121.11 150.2 41.6 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -175.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -152.76 151.47 30.53 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.734 0.302 . . . . 0.0 111.131 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -119.36 138.04 53.33 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.07 5.01 4.14 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 115.969 1.841 . . . . 0.0 115.969 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 46.7 t -66.63 -28.48 68.51 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.746 0.418 . . . . 0.0 111.449 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -95.98 -6.66 38.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.892 0.477 . . . . 0.0 111.32 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.2 t -80.45 146.99 31.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.602 0.361 . . . . 0.0 111.201 -178.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -91.28 4.43 52.35 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.48 0.312 . . . . 0.0 111.106 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -63.93 -22.91 67.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.792 0.269 . . . . 0.0 111.017 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -60.81 134.16 56.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.501 0.72 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.7 tpt85 -80.96 -33.62 33.76 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -176.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.302 56.4 m-85 -97.99 11.95 35.84 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.685 2.476 . . . . 0.0 117.685 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 79.9 p -73.64 -10.35 59.61 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -172.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.47 147.81 61.42 Favored Pre-proline 0 N--CA 1.461 0.117 0 N-CA-C 115.405 1.631 . . . . 0.0 115.405 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.77 -31.91 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.035 2.49 . . . . 0.0 112.392 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -79.15 -23.58 43.87 Favored 'General case' 0 CA--C 1.528 0.104 0 O-C-N 122.352 -0.218 . . . . 0.0 111.03 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -83.53 -41.34 18.06 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -61.33 -20.3 62.79 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.673 0.389 . . . . 0.0 111.874 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.75 -17.86 57.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -123.96 9.0 8.71 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -64.06 152.36 40.54 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.442 0.564 . . . . 0.0 111.998 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -143.85 125.97 15.49 Favored 'General case' 0 C--O 1.23 0.076 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.1 mm -143.38 -20.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.441 0.696 . . . . 0.0 110.838 -175.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 12.0 pm0 -65.4 160.67 21.44 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.513 0.725 . . . . 0.0 111.608 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 51.68 50.04 7.89 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 124.436 1.094 . . . . 0.0 113.893 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.67 146.6 84.54 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.634 2.223 . . . . 0.0 109.291 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 17.0 t -159.73 -157.91 0.61 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -175.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -83.74 0.6 46.52 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.319 0.648 . . . . 0.0 110.88 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 4.5 t -88.8 139.4 17.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 C-N-CA 123.337 0.655 . . . . 0.0 112.309 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.19 156.63 33.31 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.458 0.703 . . . . 0.0 109.556 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -122.98 141.5 51.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -134.08 159.1 41.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.624 0.726 . . . . 0.0 110.706 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -151.51 163.37 39.16 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 103.093 -2.928 . . . . 0.0 103.093 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.48 57.33 4.42 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.551 0.341 . . . . 0.0 111.271 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -127.92 150.32 73.19 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.589 0.356 . . . . 0.0 111.1 177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.37 153.36 34.66 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.7 2.933 . . . . 0.0 112.993 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 60.6 mt -68.54 -16.72 63.97 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.433 0.693 . . . . 0.0 112.506 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -122.81 23.84 9.28 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.838 0.855 . . . . 0.0 111.329 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.3 p -65.85 -12.01 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.576 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.35 -176.86 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -166.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.576 ' H ' HG21 ' A' ' 510' ' ' THR . 22.6 pt-20 -23.39 -41.49 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.0 -48.55 78.19 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 117.107 -1.425 . . . . 0.0 114.082 172.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -87.78 -27.59 22.22 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 122.481 2.4 . . . . 0.0 106.919 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -63.28 -37.74 88.43 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.308 -0.957 . . . . 0.0 113.521 175.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -73.47 -43.34 60.41 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.35 -21.17 56.47 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 119.99 -0.684 . . . . 0.0 111.823 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.7 mt -74.93 -37.6 41.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 174.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.5 m -66.22 -37.07 84.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.052 -0.405 . . . . 0.0 110.618 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -70.61 -26.86 63.69 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -74.98 -26.31 59.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.494 0.318 . . . . 0.0 110.831 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 82.2 mt -98.47 -5.26 32.72 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.05 0.54 . . . . 0.0 111.509 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.83 -1.37 54.25 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.406 0.527 . . . . 0.0 112.861 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.9 m -77.87 159.48 4.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 117.734 0.767 . . . . 0.0 112.527 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -69.38 146.14 52.34 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 123.014 0.526 . . . . 0.0 111.221 -178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -74.73 154.43 87.25 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.727 0.811 . . . . 0.0 111.44 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.76 157.19 61.24 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.382 2.722 . . . . 0.0 110.33 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -90.16 -17.15 28.13 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.1 t -158.88 155.21 27.33 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.653 0.381 . . . . 0.0 110.624 177.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.7 m -142.84 153.83 17.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 C-N-CA 123.637 0.775 . . . . 0.0 113.039 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -150.19 142.29 24.03 Favored 'General case' 0 N--CA 1.458 -0.055 0 C-N-CA 123.479 0.712 . . . . 0.0 109.71 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.39 150.79 22.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -155.81 178.83 9.82 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 94.5 p -141.66 169.78 16.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.476 0.71 . . . . 0.0 110.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 116.91 -16.91 13.29 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 123.937 0.78 . . . . 0.0 111.959 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -84.71 -24.61 28.83 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 117.522 0.661 . . . . 0.0 112.285 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.6 t -163.13 155.41 18.29 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.937 0.495 . . . . 0.0 110.153 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.79 -7.64 33.18 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.598 0.359 . . . . 0.0 110.722 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.13 -31.67 44.21 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 95.8 p -165.47 170.44 14.43 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.051 0.453 . . . . 0.0 111.724 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 47.5 t -86.26 163.82 17.52 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.6 0.76 . . . . 0.0 110.16 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 68.4 m -141.99 161.38 38.12 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.978 0.911 . . . . 0.0 108.68 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.44 43.56 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 119.888 -1.149 . . . . 0.0 113.309 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -118.77 158.35 25.75 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.782 0.833 . . . . 0.0 110.229 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 84.3 mt -141.1 157.92 44.64 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 124.594 1.157 . . . . 0.0 108.645 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -147.62 150.27 34.1 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.359 0.527 . . . . 0.0 111.567 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.7 m-90 -126.48 164.23 21.62 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.514 1.126 . . . . 0.0 112.202 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.01 -11.05 60.6 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.0 t -156.01 162.04 40.38 Favored 'General case' 0 C--N 1.339 0.138 0 O-C-N 121.536 -0.728 . . . . 0.0 111.57 -178.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -65.55 -31.82 73.07 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 122.887 0.475 . . . . 0.0 110.333 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 79.1 p -76.42 -28.46 56.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.215 0.206 . . . . 0.0 110.728 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -73.6 -34.44 65.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.62 -30.62 61.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 175.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 49.7 tp -74.92 -38.82 61.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 122.331 0.252 . . . . 0.0 111.334 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -74.1 -40.08 62.95 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.844 -0.535 . . . . 0.0 110.044 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.8 -24.67 62.61 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -68.23 -34.87 77.03 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 171.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -68.97 -32.43 73.34 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.491 -0.616 . . . . 0.0 112.302 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.287 8.2 m-85 -95.59 -9.7 31.53 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.92 -11.19 11.54 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-N 119.082 0.856 . . . . 0.0 113.254 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -74.38 138.68 43.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 119.153 0.888 . . . . 0.0 109.331 178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 60.36 22.51 12.03 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.581 0.752 . . . . 0.0 112.484 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 29.1 t80 -81.54 145.77 30.5 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -73.8 144.58 45.51 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.78 -0.575 . . . . 0.0 111.869 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 65.5 mtm -83.54 152.54 24.84 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -90.36 124.94 35.34 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 172.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -155.75 77.55 4.63 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 123.404 0.682 . . . . 0.0 109.331 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.08 -16.74 53.35 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.22 2.613 . . . . 0.0 112.203 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -88.16 -12.79 42.92 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.557 0.343 . . . . 0.0 111.594 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -93.5 161.12 24.9 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.0 -28.51 11.01 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.796 2.997 . . . . 0.0 111.341 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -158.34 151.98 19.33 Favored Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.87 162.08 43.02 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.466 2.777 . . . . 0.0 111.031 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.93 142.34 50.66 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.47 131.18 44.34 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -174.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.75 147.99 24.94 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.277 1.031 . . . . 0.0 109.347 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -140.8 154.11 46.1 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.793 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -158.59 161.37 37.24 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 27.0 p -158.36 174.82 14.55 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.495 0.718 . . . . 0.0 110.254 -176.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -59.73 124.26 19.56 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.421 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 30.2 t -85.67 150.35 24.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -171.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -110.38 9.25 23.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.66 163.37 16.51 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.609 0.764 . . . . 0.0 111.827 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 -89.58 -3.08 58.46 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.98 178.02 4.11 Favored 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 123.415 0.686 . . . . 0.0 110.142 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -136.72 18.83 3.06 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.74 0.416 . . . . 0.0 111.568 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.501 -1.238 . . . . 0.0 110.526 179.946 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 O4'-C1'-N19 112.125 3.925 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . 0.47 ' C2 ' ' HG3' ' A' ' 382' ' ' MET . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 O4'-C1'-N19 111.452 3.252 . 0.432 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 1 C3'-C2'-C1' 105.141 4.045 . 0.225 0b . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.716 1 C5'-C4'-C3' 109.11 -4.26 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 1 O4'-C1'-N19 113.844 5.644 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.519 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.785 0 C5'-C4'-C3' 109.919 -3.721 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.72 0 O4'-C1'-N19 112.12 3.92 . 0.051 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.925 0 C3'-C2'-C1' 104.531 3.368 . 0.055 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.421 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 O4'-C1'-N19 111.205 3.005 . 0.233 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.535 1 C5'-C4'-C3' 108.588 -4.608 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.284 7.8 p90 . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 178.11 -172.67 45.22 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.33 161.13 12.02 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.206 3.271 . . . . 0.0 112.184 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -155.38 160.33 40.61 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 110.893 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.98 161.41 31.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.828 0.451 . . . . 0.0 111.134 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -70.6 -5.08 26.61 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.55 145.68 10.97 Favored Pre-proline 0 N--CA 1.456 -0.127 0 O-C-N 122.183 -0.323 . . . . 0.0 111.446 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.78 -18.69 62.03 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.672 2.915 . . . . 0.0 111.626 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 5.3 t -94.57 153.68 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 C-N-CA 123.607 0.763 . . . . 0.0 112.194 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -141.09 153.52 45.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.271 1.028 . . . . 0.0 108.789 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 74.1 mmm -130.39 133.73 46.6 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 122.91 0.484 . . . . 0.0 111.695 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.75 151.78 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.22 177.99 8.22 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 105.38 -2.082 . . . . 0.0 105.38 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 82.3 12.04 81.25 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 112.034 -0.427 . . . . 0.0 112.034 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 48.8 mt -78.24 26.26 0.21 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.514 0.657 . . . . 0.0 112.203 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -64.37 -37.89 89.1 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -176.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . 0.4 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.6 pm0 -67.07 150.42 49.22 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.182 0.515 . . . . 0.0 111.055 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -70.04 -8.71 51.52 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.666 0.786 . . . . 0.0 112.974 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -76.85 -13.88 59.95 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.73 0.412 . . . . 0.0 111.676 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 56.4 mmm -85.07 152.15 23.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.963 0.411 . . . . 0.0 111.099 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.73 155.37 23.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 175.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . 0.421 ' HA ' ' CE1' ' A' ' 411' ' ' PHE . 24.2 p -57.42 -32.0 66.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -175.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.06 -47.97 63.96 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 175.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.9 mtt85 -70.55 -39.11 74.17 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 116.821 -0.172 . . . . 0.0 110.972 -171.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.74 -46.35 74.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -77.68 -28.65 51.17 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.712 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -77.31 -29.11 53.51 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.392 0.997 . . . . 0.0 110.097 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.93 -56.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.555 2.3 p90 -76.66 -3.21 36.65 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 173.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.01 -36.87 67.08 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.866 -0.521 . . . . 0.0 110.559 177.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.15 -11.67 22.11 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.779 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -89.22 -3.79 58.44 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.95 -169.82 41.05 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 118.795 0.725 . . . . 0.0 112.91 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -78.46 114.28 17.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 2.5 m -114.09 165.49 9.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -127.87 -59.49 1.19 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -154.42 167.81 28.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -172.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.1 150.42 15.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 124.827 1.251 . . . . 0.0 109.84 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -151.54 128.78 11.21 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 123.353 0.661 . . . . 0.0 110.805 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . 0.421 ' CE1' ' HA ' ' A' ' 393' ' ' CYS . 3.3 m-85 -82.84 156.95 23.35 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 117.396 2.369 . . . . 0.0 117.396 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.17 127.77 37.77 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.712 0.405 . . . . 0.0 110.846 175.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . 0.578 ' HE2' " H5'" ' B' ' 4' ' ' ' C' . 0.0 OUTLIER -79.21 -29.14 42.66 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.849 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 52.2 p -102.02 -19.51 15.17 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -80.5 154.27 73.9 Favored Pre-proline 0 CA--C 1.528 0.129 0 CA-C-N 118.456 0.571 . . . . 0.0 110.047 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.84 -15.87 48.39 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.085 2.523 . . . . 0.0 111.136 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 166.66 98.19 0.12 Allowed Glycine 0 C--N 1.336 0.538 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 176.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.17 37.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.334 0.654 . . . . 0.0 110.209 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.75 148.85 19.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 62.8 mtp -85.03 150.77 24.64 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.348 1.059 . . . . 0.0 109.037 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.89 146.39 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 C-N-CA 123.48 0.712 . . . . 0.0 110.414 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . 0.411 ' C ' ' HG3' ' A' ' 423' ' ' MET . 71.4 tt0 -129.42 129.81 45.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.374 0.534 . . . . 0.0 109.888 176.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' MET . . . . . 0.411 ' HG3' ' C ' ' A' ' 422' ' ' GLU . 49.9 mtp -150.77 167.68 26.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.335 1.054 . . . . 0.0 109.389 -169.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.76 122.38 17.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 170.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -72.34 -33.21 67.12 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -167.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.45 -89.57 0.01 OUTLIER Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.56 -25.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -89.52 -35.15 16.1 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.99 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 81.6 t -85.94 -26.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.345 0.401 0 C-N-CA 118.217 -1.393 . . . . 0.0 109.025 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -68.42 -50.06 55.51 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -66.91 -33.18 75.02 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 120.266 -0.574 . . . . 0.0 112.262 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.23 -36.72 82.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.841 0.746 . . . . 0.0 110.2 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.1 mt -79.21 -8.1 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.55 0.74 . . . . 0.0 111.184 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.7 m -100.08 -21.26 15.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -124.53 -27.77 3.68 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 -169.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.7 mt -134.52 -10.63 2.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.483 1.492 . . . . 0.0 114.711 -173.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.557 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -71.86 100.77 2.48 Favored 'General case' 0 C--O 1.204 -1.335 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -169.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.578 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 13.4 m-80 76.73 22.16 1.17 Allowed 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 123.381 2.81 . . . . 0.0 112.811 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.52 161.3 18.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 168.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.271 37.6 m-85 -74.47 138.4 43.2 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' MET . . . . . 0.448 ' HE2' ' CE2' ' A' ' 442' ' ' PHE . 19.0 ttt -157.11 142.53 17.37 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.386 0.674 . . . . 0.0 109.603 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.448 ' CE2' ' HE2' ' A' ' 441' ' ' MET . 61.0 m-85 59.34 17.55 5.95 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.42 85.31 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -173.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -133.32 -159.35 0.96 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.773 1.629 . . . . 0.0 108.598 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -128.62 151.02 49.96 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.551 0.341 . . . . 0.0 110.779 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -129.25 82.58 2.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.578 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.2 m120 -58.69 127.4 31.99 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 115.98 -1.962 . . . . 0.0 113.343 -172.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.557 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.409 2.1 t -129.94 150.93 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 113.593 -3.243 . . . . 0.0 115.953 168.699 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.3 t -161.49 167.7 25.02 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.585 1.154 . . . . 0.0 109.27 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -72.31 150.86 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 41.6 t -90.71 166.56 13.07 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.334 0.653 . . . . 0.0 111.492 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -106.13 -6.42 18.61 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.621 0.368 . . . . 0.0 110.455 175.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -77.74 152.03 80.13 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 123.98 0.912 . . . . 0.0 111.613 -178.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.52 -38.89 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 123.14 2.56 . . . . 0.0 112.045 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.55 159.38 10.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.608 0.763 . . . . 0.0 110.479 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 64.9 mt -80.51 128.87 38.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 24.8 mmm -94.78 140.61 22.62 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.361 0.265 . . . . 0.0 111.292 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -73.38 158.18 48.59 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 123.318 2.679 . . . . 0.0 109.065 172.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 160.33 -133.95 3.45 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.694 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -72.31 167.8 19.69 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.441 0.696 . . . . 0.0 111.419 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.7 p -154.83 167.78 29.09 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.738 0.815 . . . . 0.0 109.785 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.78 -1.61 0.98 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.62 -171.14 54.41 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.5 mt -142.26 159.96 41.19 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.138 0.975 . . . . 0.0 109.229 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.55 -19.34 62.9 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -120.44 25.5 9.76 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -160.66 -159.15 9.71 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.7 t -133.0 -15.95 2.56 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 80.1 m -127.04 143.69 51.22 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.595 0.358 . . . . 0.0 111.441 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 71.9 p -93.84 3.47 55.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.348 0.659 . . . . 0.0 110.894 175.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -142.74 149.57 38.92 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.115 1.366 . . . . 0.0 114.254 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . 0.439 ' HD2' ' H ' ' A' ' 473' ' ' ASP . 54.5 tptt -154.61 152.88 30.53 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 117.994 0.361 . . . . 0.0 111.454 -178.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . 0.439 ' H ' ' HD2' ' A' ' 472' ' ' LYS . 5.8 t0 -124.24 128.88 49.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.203 1.401 . . . . 0.0 112.45 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.282 3.3 m-85 -91.22 -6.64 53.07 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -177.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.7 t -75.09 -33.52 61.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -81.22 -17.07 50.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.575 0.35 . . . . 0.0 110.468 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 54.7 m -91.31 -3.81 56.47 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 60.91 -1.93 0.22 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.755 1.222 . . . . 0.0 113.204 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -64.73 -22.36 66.96 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.097 0.559 . . . . 0.0 112.064 -176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -59.42 115.6 3.38 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -81.02 -24.14 38.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.331 -0.395 . . . . 0.0 112.015 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.301 62.5 m-85 -97.94 17.44 18.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -64.1 -20.05 65.69 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.04 154.1 70.03 Favored Pre-proline 0 C--O 1.232 0.156 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 177.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -64.1 -23.49 67.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.087 2.525 . . . . 0.0 111.679 177.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -75.76 -29.46 58.82 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.331 -0.231 . . . . 0.0 110.675 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -82.0 -38.95 24.3 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.56 -19.67 65.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.667 0.387 . . . . 0.0 111.81 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.82 -16.73 54.91 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.0 0.37 8.52 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -65.33 157.25 29.66 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.289 178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.71 118.28 10.96 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.93 41.85 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.437 0.695 . . . . 0.0 111.042 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -64.68 167.92 6.73 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.904 -0.498 . . . . 0.0 110.092 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -57.6 151.12 42.23 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 122.693 0.397 . . . . 0.0 110.777 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.12 162.27 36.42 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 123.479 2.786 . . . . 0.0 110.838 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 33.2 t -158.05 -176.86 6.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -83.68 -3.72 57.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -88.13 146.42 6.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 123.621 0.768 . . . . 0.0 112.572 175.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 8.8 tp -137.38 152.23 49.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.027 0.531 . . . . 0.0 109.833 -178.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -123.9 147.75 47.41 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.838 0.855 . . . . 0.0 109.131 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -142.29 161.53 37.79 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.689 0.757 . . . . 0.0 109.983 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -153.7 166.12 33.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 58.25 57.44 3.95 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.646 0.378 . . . . 0.0 111.434 -174.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -124.86 154.9 70.86 Favored Pre-proline 0 CA--C 1.533 0.299 0 C-N-CA 123.629 0.772 . . . . 0.0 109.935 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.41 156.74 64.91 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.202 1.935 . . . . 0.0 110.305 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.42 -16.53 63.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -173.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -115.36 25.14 11.06 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.5 0.72 . . . . 0.0 111.385 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.85 -14.24 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.563 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.96 -177.25 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -164.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.563 ' H ' HG23 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.53 -39.4 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.1 mt-10 -59.27 -45.88 90.03 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 116.956 -1.497 . . . . 0.0 114.77 172.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -88.22 -27.18 21.95 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 122.852 2.569 . . . . 0.0 106.865 -174.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -65.77 -36.08 82.52 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.426 -0.909 . . . . 0.0 113.308 175.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -74.08 -44.26 54.68 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -76.59 -25.0 53.47 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.755 -0.778 . . . . 0.0 111.739 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.2 mt -72.22 -40.56 65.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 O-C-N 121.75 -0.594 . . . . 0.0 110.027 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 74.3 m -65.31 -30.24 71.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.23 0.468 . . . . 0.0 111.294 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -66.91 -39.44 87.4 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.915 0.388 . . . . 0.0 112.026 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -73.42 -6.75 48.29 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.04 -3.73 12.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.865 0.466 . . . . 0.0 111.778 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.88 -16.71 3.15 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.995 0.807 . . . . 0.0 113.931 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.5 m -77.39 156.8 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 118.461 1.13 . . . . 0.0 108.771 177.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -70.83 150.33 45.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.087 0.47 . . . . 0.0 111.496 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -76.19 157.41 83.1 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.311 0.644 . . . . 0.0 110.065 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.41 151.09 83.93 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 122.959 2.44 . . . . 0.0 110.549 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.0 t -83.53 -22.98 32.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -148.67 150.61 33.51 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.282 0.633 . . . . 0.0 110.665 178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.8 m -144.52 156.1 14.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 C-N-CA 123.655 0.782 . . . . 0.0 112.676 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -154.71 144.67 21.74 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.529 0.732 . . . . 0.0 109.505 175.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.96 152.48 28.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -155.51 -177.75 6.78 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.994 1.849 . . . . 0.0 115.994 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.1 p -143.49 -170.34 3.27 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.211 1.004 . . . . 0.0 109.846 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.56 -9.22 62.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.758 0.694 . . . . 0.0 112.254 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -94.43 -26.91 16.3 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 117.54 0.67 . . . . 0.0 111.648 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.4 t -164.59 156.94 16.44 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.235 0.614 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.99 -8.03 31.54 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.842 0.457 . . . . 0.0 110.787 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.26 -33.64 37.7 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 28.0 t -164.94 157.43 16.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.63 0.252 . . . . 0.0 111.651 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 95.3 p -82.9 176.24 9.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.454 0.702 . . . . 0.0 111.051 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.0 t -149.05 162.71 39.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.095 0.958 . . . . 0.0 108.445 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.31 -174.45 47.0 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.124 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.52 160.18 23.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.598 0.759 . . . . 0.0 110.394 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.5 mt -139.77 161.33 37.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.113 1.365 . . . . 0.0 108.347 178.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -151.38 148.39 28.07 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.248 -0.282 . . . . 0.0 111.573 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 22.2 m-90 -129.07 173.67 10.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.877 1.271 . . . . 0.0 111.915 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -7.99 54.74 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 46.8 t -162.03 165.06 27.83 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.193 -0.317 . . . . 0.0 111.295 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.92 -37.62 86.54 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 122.968 0.507 . . . . 0.0 110.269 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.2 p -72.26 -27.26 62.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -71.8 -39.75 69.67 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 175.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.6 -27.14 60.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 62.4 tp -77.89 -40.35 40.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -178.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -70.96 -36.76 72.69 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.65 -23.78 59.91 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -44.57 76.83 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -61.55 -37.16 93.72 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-O 119.668 -0.518 . . . . 0.0 112.113 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.292 25.2 m-85 -84.95 -13.33 51.05 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.9 mt -110.81 -10.15 14.45 Favored 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -72.62 144.19 47.91 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.274 0.943 . . . . 0.0 108.829 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 58.77 18.96 6.44 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.952 0.901 . . . . 0.0 112.852 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.45 131.78 51.29 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -77.38 124.83 28.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 121.866 -0.522 . . . . 0.0 110.747 -177.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.0 mtm -83.54 152.57 24.82 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.287 0.235 . . . . 0.0 111.406 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -74.19 145.83 43.88 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -156.42 79.0 4.01 Favored Pre-proline 0 N--CA 1.455 -0.21 0 O-C-N 122.435 -0.166 . . . . 0.0 110.684 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -72.15 -9.93 25.17 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 123.083 2.522 . . . . 0.0 111.027 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.52 5.7 50.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.565 0.746 . . . . 0.0 112.455 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -153.13 166.79 31.65 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-N 118.314 0.506 . . . . 0.0 112.196 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.88 -17.44 22.6 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 124.268 3.312 . . . . 0.0 112.393 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -150.14 150.83 30.56 Favored Pre-proline 0 C--O 1.231 0.124 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.99 167.41 27.12 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.889 3.059 . . . . 0.0 111.266 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -129.87 142.44 50.67 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 103.177 -2.897 . . . . 0.0 103.177 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.271 0.7 OUTLIER -81.63 141.14 33.95 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -178.018 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.8 tt -86.46 152.52 22.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.954 1.302 . . . . 0.0 109.455 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.0 pttp -140.44 153.53 46.32 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.159 0.436 . . . . 0.0 110.697 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.46 161.71 38.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.191 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.5 p -161.6 171.52 17.89 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.971 0.909 . . . . 0.0 110.908 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -55.67 125.33 20.67 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.409 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 31.2 t -81.65 150.16 28.19 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -171.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -113.72 9.3 17.71 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.91 163.15 20.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.831 0.852 . . . . 0.0 111.542 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -89.41 -7.27 55.51 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.347 0.659 . . . . 0.0 111.776 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -172.49 172.21 4.41 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.668 0.787 . . . . 0.0 110.273 176.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -140.92 20.31 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.243 0.617 . . . . 0.0 111.793 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.2 t . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.691 -1.147 . . . . 0.0 110.499 179.878 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.728 0 O4'-C1'-N19 111.565 3.365 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.418 0 C5'-C4'-C3' 110.391 -3.406 . 0.386 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.509 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.895 0 O4'-C1'-N19 112.07 3.87 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . 0.578 " H5'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.818 1 C5'-C4'-C3' 108.261 -4.826 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 1 O4'-C1'-N19 113.43 5.23 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.557 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.865 0 C5'-C4'-C3' 109.741 -3.839 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C5'-C4'-C3' 110.978 -3.015 . 0.01 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C3'-C2'-C1' 104.509 3.343 . 0.063 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.409 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 O4'-C1'-N19 111.092 2.892 . 0.241 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.67 1 C5'-C4'-C3' 108.223 -4.851 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.291 7.3 p90 . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 75.08 -177.88 47.61 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.871 -0.491 . . . . 0.0 111.871 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -59.69 158.46 28.21 Favored 'Trans proline' 0 N--CA 1.454 -0.849 0 C-N-CA 124.515 3.477 . . . . 0.0 112.435 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -157.72 153.52 26.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.801 0.44 . . . . 0.0 110.701 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -77.8 157.78 29.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.468 0.307 . . . . 0.0 110.3 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 8.6 p30 -84.02 6.57 21.56 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 115.886 1.809 . . . . 0.0 115.886 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -153.72 143.98 15.62 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 119.387 -0.339 . . . . 0.0 111.105 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.22 -3.03 3.56 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.387 3.391 . . . . 0.0 113.455 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.06 151.01 28.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -122.37 153.54 38.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.526 1.531 . . . . 0.0 108.291 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.7 tpt -135.13 128.41 32.08 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 117.773 0.26 . . . . 0.0 110.64 -176.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -122.4 153.23 26.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -175.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.467 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 3.2 m-85 -142.98 175.91 9.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.365 -2.458 . . . . 0.0 104.365 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.64 15.91 67.17 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 37.7 mt -86.46 19.6 2.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.389 0.675 . . . . 0.0 111.557 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.321 8.4 p30 -73.48 32.29 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 117.285 2.328 . . . . 0.0 117.285 -173.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -140.55 154.54 46.57 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 110.29 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 86.8 p -66.05 -11.45 48.44 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -78.63 -9.49 59.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.203 0.456 . . . . 0.0 111.635 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 60.1 mmm -97.32 149.75 21.74 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 117.936 0.334 . . . . 0.0 110.224 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -161.55 154.86 21.2 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 22.3 p -59.18 -35.8 74.19 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.16 -38.71 78.89 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -74.4 -51.33 15.3 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.98 -33.9 63.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.211 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.443 ' HA ' ' CE1' ' A' ' 400' ' ' PHE . 5.5 t80 -75.66 -30.64 59.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.584 -174.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -74.83 -32.46 61.95 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.443 1.019 . . . . 0.0 110.068 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 30.0 t -57.52 -57.7 9.13 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 397' ' ' PHE 0.49 2.6 p90 -76.54 -5.08 46.08 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 117.646 2.462 . . . . 0.0 117.646 174.556 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . 0.41 ' HA ' HG12 ' A' ' 406' ' ' VAL . 40.5 t -74.32 -34.54 63.48 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 118.198 0.453 . . . . 0.0 111.133 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.41 -16.46 46.9 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.959 177.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . 0.252 55.2 m-85 -85.08 -5.28 59.35 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 118.298 2.703 . . . . 0.0 118.298 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.91 -167.07 39.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.475 -0.869 . . . . 0.0 113.303 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -84.95 120.06 26.07 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.683 0.793 . . . . 0.0 109.361 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 401' ' ' CYS . 1.4 m -113.94 165.49 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.053 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -174.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -133.36 -57.36 0.9 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -149.79 164.28 35.72 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.44 147.01 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 124.625 1.17 . . . . 0.0 109.073 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.4 130.36 11.0 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.335 0.254 . . . . 0.0 111.64 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.3 m-85 -85.0 156.08 21.29 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.9 mmt -95.75 118.02 31.63 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.534 0.733 . . . . 0.0 112.244 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -79.11 -14.35 59.18 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.914 0.485 . . . . 0.0 111.124 172.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.7 p -90.26 1.47 56.47 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.625 0.77 . . . . 0.0 111.875 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . 0.419 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 46.8 mmtm -136.06 155.21 77.76 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 123.664 0.786 . . . . 0.0 110.46 -176.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.76 -15.67 33.37 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.249 2.633 . . . . 0.0 111.624 178.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.78 95.21 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.14 159.42 36.16 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.879 0.872 . . . . 0.0 109.281 177.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.56 156.64 21.1 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 71.8 mtm -102.58 154.73 18.84 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.427 0.691 . . . . 0.0 109.997 172.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.05 124.93 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 123.314 0.646 . . . . 0.0 110.893 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -103.62 127.84 51.0 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtm -154.63 172.4 17.92 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.796 0.838 . . . . 0.0 109.85 -174.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -64.79 122.07 16.04 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -72.35 -33.47 67.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.79 -87.97 0.01 OUTLIER Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -73.01 -26.81 61.46 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 117.185 2.291 . . . . 0.0 117.185 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -85.8 -37.19 19.52 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.052 -1.059 . . . . 0.0 111.798 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.0 t -85.87 -26.22 6.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.622 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -66.42 -51.91 52.0 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.164 -0.335 . . . . 0.0 111.391 175.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -69.93 -31.15 68.77 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.38 72.66 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.915 0.78 . . . . 0.0 110.089 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -78.11 -15.48 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 123.222 0.609 . . . . 0.0 110.752 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.4 m -93.01 -18.88 22.15 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.77 -21.37 3.08 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -170.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.71 -12.34 2.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.956 1.707 . . . . 0.0 114.311 -174.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.546 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.73 100.92 2.45 Favored 'General case' 0 C--O 1.205 -1.237 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -168.172 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.559 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 15.0 m-80 77.04 21.51 1.11 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 123.159 2.709 . . . . 0.0 113.771 -161.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -78.84 161.32 26.85 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.94 -1.1 . . . . 0.0 111.155 168.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . 0.403 ' CZ ' ' HE3' ' A' ' 445' ' ' LYS . 55.7 m-85 -71.3 142.42 50.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.2 ttt -162.5 134.52 5.42 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.392 50.8 m-85 55.98 27.32 11.06 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 83.72 8.78 84.02 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -132.5 178.33 6.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.315 1.046 . . . . 0.0 109.266 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . 0.403 ' HE3' ' CZ ' ' A' ' 440' ' ' PHE . 40.1 ttmt -125.19 133.75 52.64 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 111.033 178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 63.0 mtm -80.63 -158.18 0.18 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.404 1.082 . . . . 0.0 109.046 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.559 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 37.1 t-20 -162.59 123.26 2.46 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 115.631 -2.128 . . . . 0.0 108.599 168.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.45 2.2 t -125.86 151.42 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 112.337 -3.745 . . . . 0.0 116.556 170.371 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 26.1 t -161.38 174.94 12.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.714 1.606 . . . . 0.0 107.938 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.2 p -73.95 149.36 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.3 t -84.21 158.45 21.29 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.882 0.473 . . . . 0.0 110.973 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.41 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 65.0 pttt -104.45 -1.81 26.21 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.459 -0.151 . . . . 0.0 110.692 176.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -86.79 146.47 41.18 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 123.176 0.59 . . . . 0.0 110.066 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.57 -31.14 4.49 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.319 2.68 . . . . 0.0 112.493 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.47 161.28 13.81 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.022 0.529 . . . . 0.0 110.382 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 79.0 mt -87.76 136.54 22.9 Favored 'Isoleucine or valine' 0 C--O 1.23 0.062 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 59.8 mmm -101.39 130.16 25.38 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.458 0.303 . . . . 0.0 110.913 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.54 171.42 18.07 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.608 2.872 . . . . 0.0 110.402 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 131.41 -125.41 4.4 Favored Glycine 0 C--N 1.336 0.551 0 N-CA-C 111.424 -0.67 . . . . 0.0 111.424 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -72.47 164.91 25.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.361 0.6 . . . . 0.0 112.21 -176.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 97.0 p -158.4 -179.16 7.84 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.154 0.981 . . . . 0.0 109.529 -177.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -140.88 161.96 36.58 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -80.65 131.69 10.67 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.4 mt -80.0 166.81 21.2 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.07 -22.57 64.0 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.248 -0.282 . . . . 0.0 111.178 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -120.52 25.83 9.54 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.154 0.582 . . . . 0.0 110.242 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.36 -163.07 14.33 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 121.859 -0.526 . . . . 0.0 112.419 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 48.4 t -133.09 -16.69 2.46 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.061 0.544 . . . . 0.0 111.551 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.5 t -127.09 145.98 50.54 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.957 0.503 . . . . 0.0 110.059 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 89.8 p -97.47 9.51 42.19 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.403 0.681 . . . . 0.0 111.628 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -136.15 147.24 47.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -157.84 154.15 27.55 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.606 0.362 . . . . 0.0 110.188 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 2.4 t0 -131.85 130.3 41.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -93.63 -8.89 39.8 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 117.252 2.315 . . . . 0.0 117.252 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 48.3 t -87.19 -32.27 19.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -79.25 3.8 16.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.568 0.747 . . . . 0.0 111.711 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 77.4 p -134.21 9.01 3.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.292 0.637 . . . . 0.0 111.767 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 62.77 -0.86 0.52 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.845 1.258 . . . . 0.0 113.986 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -59.21 -26.6 64.98 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.698 -0.626 . . . . 0.0 111.864 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -56.32 124.21 17.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.167 0.987 . . . . 0.0 109.994 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -81.02 -32.14 34.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -172.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.306 63.2 m-85 -97.92 17.1 18.99 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -69.12 -14.31 62.92 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -173.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.58 151.75 71.53 Favored Pre-proline 0 C--O 1.232 0.139 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -65.0 -23.83 60.88 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 123.02 2.48 . . . . 0.0 111.426 176.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -75.71 -29.7 59.05 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.359 0.263 . . . . 0.0 110.452 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -82.4 -41.98 19.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 174.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.83 64.81 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -80.79 -19.04 45.66 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -4.5 7.96 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -63.67 157.14 24.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.276 0.489 . . . . 0.0 110.414 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -150.44 144.83 25.66 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.4 mm -137.65 148.05 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 123.331 0.652 . . . . 0.0 110.225 -171.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -150.51 169.04 22.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.108 0.963 . . . . 0.0 110.186 178.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -62.88 155.92 69.02 Favored Pre-proline 0 N--CA 1.455 -0.213 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -62.21 145.49 96.19 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 122.521 2.147 . . . . 0.0 109.561 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.2 t -153.98 173.99 15.25 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.978 0.511 . . . . 0.0 109.653 -174.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.71 -3.06 57.47 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.268 -0.27 . . . . 0.0 110.935 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -98.38 135.86 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 64.8 mt -125.41 152.14 45.25 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.372 0.669 . . . . 0.0 109.717 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -110.51 143.59 40.64 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 173.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -131.28 157.77 42.42 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.224 0.535 . . . . 0.0 111.647 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -152.19 167.68 27.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 103.847 -2.649 . . . . 0.0 103.847 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 54.39 31.87 15.39 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -93.57 156.21 39.93 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 117.685 0.22 . . . . 0.0 110.864 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.73 151.14 57.65 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 123.326 2.684 . . . . 0.0 111.754 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.46 -16.58 63.95 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.315 0.646 . . . . 0.0 112.412 -177.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -122.67 26.42 8.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.579 0.752 . . . . 0.0 111.005 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.57 -14.22 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.572 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.3 OUTLIER -54.74 -177.39 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -165.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.572 ' H ' HG21 ' A' ' 510' ' ' THR . 84.6 tt0 -10.33 -53.74 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.176 1.79 . . . . 0.0 114.919 -174.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.5 mt-10 -61.4 -41.18 96.72 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -89.35 -27.33 20.56 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 123.262 2.755 . . . . 0.0 106.398 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -61.71 -39.96 93.37 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.875 -1.13 . . . . 0.0 113.09 174.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -70.47 -45.95 64.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -77.88 -24.95 48.33 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 119.918 -0.713 . . . . 0.0 111.468 -177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 53.2 mt -70.53 -39.14 75.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 118.867 0.758 . . . . 0.0 109.417 176.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 85.6 m -65.66 -32.8 74.56 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.98 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -70.16 -27.18 64.33 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -80.02 -9.19 59.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.273 0.229 . . . . 0.0 111.577 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.26 -5.95 14.61 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.096 0.558 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.55 -10.06 13.48 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 123.715 0.674 . . . . 0.0 113.025 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.9 m -79.82 159.03 4.46 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.102 0 CA-C-N 118.131 0.966 . . . . 0.0 112.45 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -67.59 148.44 51.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 121.179 0.514 . . . . 0.0 111.376 -176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -81.6 158.07 68.97 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.602 0.761 . . . . 0.0 110.884 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.24 170.88 12.41 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 123.864 3.043 . . . . 0.0 110.43 172.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -119.21 -17.97 8.77 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 64.5 m -147.49 146.84 29.65 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 123.187 0.595 . . . . 0.0 109.884 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.24 156.94 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -175.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -150.34 141.05 22.66 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -138.53 142.17 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -154.06 -172.79 4.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 22.8 t -136.84 -174.29 3.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.625 0.77 . . . . 0.0 110.11 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.88 -15.53 62.53 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.04 0.828 . . . . 0.0 111.758 -178.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 50.4 mmtm -88.46 -28.32 20.93 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.453 0.627 . . . . 0.0 110.742 175.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.9 t -166.31 158.93 14.4 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.76 . . . . 0.0 109.963 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -117.05 -4.19 11.5 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.441 0.696 . . . . 0.0 109.855 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -24.26 21.55 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.654 0.782 . . . . 0.0 110.637 -179.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 13.0 m -158.71 167.17 30.22 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.763 0.825 . . . . 0.0 111.073 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 46.9 t -79.61 164.13 24.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.64 0.776 . . . . 0.0 111.569 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 39.6 t -151.95 150.42 30.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.479 1.111 . . . . 0.0 109.376 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 170.56 -173.6 44.43 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.815 -178.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -112.05 157.66 20.5 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 123.318 0.647 . . . . 0.0 110.17 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 28.2 tp -146.32 151.74 38.01 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -147.04 149.25 32.73 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.7 m-90 -121.38 172.0 8.36 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.491 1.516 . . . . 0.0 112.536 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -74.99 -11.07 60.03 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.612 0.365 . . . . 0.0 111.137 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -156.72 158.96 37.86 Favored 'General case' 0 C--O 1.232 0.135 0 O-C-N 121.629 -0.669 . . . . 0.0 111.375 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.5 -26.25 62.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.537 0.335 . . . . 0.0 110.851 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.1 p -78.64 -25.53 45.01 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.75 -35.36 70.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 175.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.4 -28.55 59.48 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.755 -0.202 . . . . 0.0 110.665 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 39.6 tp -72.79 -44.02 62.06 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 117.875 0.307 . . . . 0.0 111.131 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -72.72 -39.48 66.89 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.904 -0.498 . . . . 0.0 109.947 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.47 -26.92 65.73 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 176.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.23 -32.39 72.56 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 172.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.39 -41.48 99.76 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.265 10.5 m-85 -89.05 -18.79 26.59 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.743 2.868 . . . . 0.0 118.743 178.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.81 -16.68 15.33 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.754 0.706 . . . . 0.0 112.323 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -73.82 143.81 45.78 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 119.317 0.962 . . . . 0.0 108.846 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.85 18.45 2.99 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.516 1.126 . . . . 0.0 112.966 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.264 43.8 t80 -72.88 138.55 46.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -73.86 134.03 43.24 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.131 -0.356 . . . . 0.0 111.813 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.6 mtm -84.58 152.6 23.75 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 122.679 0.392 . . . . 0.0 111.663 176.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 168.77 17.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 170.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -150.04 149.28 27.02 Favored Pre-proline 0 CA--C 1.532 0.262 0 O-C-N 122.28 -0.263 . . . . 0.0 111.107 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.4 -29.59 9.18 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.304 2.669 . . . . 0.0 112.421 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -160.53 8.07 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -67.28 148.28 49.88 Favored Glycine 0 CA--C 1.532 1.123 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 -177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.94 -24.29 17.72 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.417 2.745 . . . . 0.0 111.368 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -153.55 149.82 22.06 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -74.59 163.51 35.79 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.663 2.909 . . . . 0.0 111.238 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -129.91 142.33 50.67 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 174.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.7 OUTLIER -81.94 138.7 34.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -177.559 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.8 tt -79.67 152.29 30.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.528 ' HB2' ' HZ2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -140.64 153.5 46.05 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.902 0.319 . . . . 0.0 110.665 179.136 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.33 166.33 33.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.784 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 43.1 t -155.92 160.03 39.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.91 0.884 . . . . 0.0 109.761 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -57.37 119.2 6.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.468 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 38.9 t -76.14 148.15 38.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.8 t -114.14 11.77 17.66 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 169.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.6 163.04 22.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.887 0.875 . . . . 0.0 111.942 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -93.53 -3.14 53.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.742 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -153.33 170.56 20.34 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.539 0.736 . . . . 0.0 110.752 -177.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.34 23.49 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.051 0.94 . . . . 0.0 109.873 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.369 -1.3 . . . . 0.0 110.61 -176.116 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.467 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.697 1 O4'-C1'-N19 112.335 4.135 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . 0.41 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.75 0 C5'-C4'-C3' 110.428 -3.381 . 0.34 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.552 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.955 0 C3'-C2'-C1' 104.915 3.794 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.91 1 C5'-C4'-C3' 108.6 -4.6 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.45 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.897 1 O4'-C1'-N19 112.755 4.555 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.495 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.821 0 C5'-C4'-C3' 109.711 -3.86 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.874 0 O4'-C1'-N19 111.269 3.069 . 0.098 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.927 0 C3'-C2'-C1' 105.022 3.914 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.468 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 O4'-C1'-N19 111.946 3.746 . 0.189 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 2 C5'-C4'-C3' 108.364 -4.758 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.255 8.0 p90 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -72.71 171.31 50.21 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.34 162.48 41.7 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.124 3.216 . . . . 0.0 111.08 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -156.01 156.51 34.56 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.796 0.439 . . . . 0.0 110.564 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.05 160.68 30.94 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.879 0.472 . . . . 0.0 111.034 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -73.78 -7.34 51.76 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 28.7 t -159.92 148.37 13.55 Favored Pre-proline 0 C--O 1.232 0.144 0 C-N-CA 122.924 0.489 . . . . 0.0 110.547 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.55 -16.01 46.19 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.26 2.64 . . . . 0.0 110.557 174.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -85.37 150.55 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.44 156.3 46.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.65 1.18 . . . . 0.0 108.563 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 45.6 tpp -137.48 135.72 37.08 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.208 -0.308 . . . . 0.0 111.082 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.17 152.0 34.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -176.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -138.78 177.9 7.55 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 9.89 82.2 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.896 -0.391 . . . . 0.0 112.255 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 44.4 mt -78.27 28.03 0.19 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.473 0.709 . . . . 0.0 111.851 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -64.89 -27.55 68.93 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -175.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . 0.434 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.5 pm0 -79.16 150.91 31.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.006 0.431 . . . . 0.0 111.208 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.7 m -70.72 -5.83 32.77 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.02 -15.32 61.52 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 118.093 0.406 . . . . 0.0 111.921 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 71.3 mmm -95.13 147.08 23.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.196 0.453 . . . . 0.0 111.382 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -158.73 163.52 36.72 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.357 1.063 . . . . 0.0 108.508 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 86.8 m -54.28 -44.62 72.04 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.061 0.391 . . . . 0.0 110.857 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -68.01 -37.28 81.24 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -74.08 -48.39 30.07 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.09 -39.62 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.456 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 6.9 t80 -75.91 -31.91 59.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -71.05 -38.45 72.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.159 0.436 . . . . 0.0 110.198 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -61.82 -48.32 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 120.102 -0.639 . . . . 0.0 112.608 -176.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.523 2.5 p90 -76.6 -12.07 59.96 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 168.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.3 t -66.86 -24.79 66.18 Favored 'General case' 0 C--N 1.338 0.071 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.52 -37.16 25.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.242 0.617 . . . . 0.0 110.926 173.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -79.51 -14.86 58.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -176.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.16 -174.6 45.99 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 118.939 0.791 . . . . 0.0 112.946 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -73.54 124.88 26.73 Favored 'General case' 0 C--O 1.231 0.109 0 O-C-N 122.644 -0.327 . . . . 0.0 111.754 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.456 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.4 m -114.09 165.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.096 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 178.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -126.42 -59.51 1.3 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -146.58 166.18 27.27 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 118.852 0.751 . . . . 0.0 112.98 -173.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.28 148.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 124.472 1.109 . . . . 0.0 109.332 175.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -157.3 126.19 5.81 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.116 0.566 . . . . 0.0 111.042 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.92 153.87 38.41 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 36.4 mmt -86.62 117.03 25.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.308 0.643 . . . . 0.0 110.317 175.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -79.21 -15.77 57.55 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.425 -0.172 . . . . 0.0 111.4 171.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 32.5 t -90.15 -5.88 55.98 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -124.34 154.81 69.1 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 123.351 0.66 . . . . 0.0 109.836 -176.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.26 -17.06 40.03 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.412 2.741 . . . . 0.0 111.86 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.08 94.75 0.09 OUTLIER Glycine 0 C--N 1.336 0.536 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.41 163.01 35.84 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.537 0.735 . . . . 0.0 109.462 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.39 143.04 13.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 84.7 mtp -82.59 151.68 26.27 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.8 t -146.53 153.79 12.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -135.22 133.42 39.0 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.102 -0.374 . . . . 0.0 110.002 177.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 60.4 mtp -150.59 169.35 21.77 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.197 0.999 . . . . 0.0 109.461 -171.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.9 123.04 18.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 171.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.2 p30 -72.29 -33.55 67.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 -166.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.37 -89.62 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.33 -25.47 60.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.72 -32.68 16.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 118.735 -1.186 . . . . 0.0 112.208 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.68 -24.31 6.09 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 C-N-CA 118.04 -1.464 . . . . 0.0 109.031 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -69.34 -47.78 63.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.785 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -63.7 -40.25 96.31 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.06 -36.72 85.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.464 0.574 . . . . 0.0 110.589 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.8 mt -81.73 -10.16 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 123.066 0.547 . . . . 0.0 111.706 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 52.8 m -102.26 -16.56 16.27 Favored 'General case' 0 N--CA 1.461 0.082 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -135.42 -19.74 1.65 Allowed 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -170.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 8.9 tp -134.57 -15.34 2.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -170.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.565 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 17.8 p-10 -71.38 101.0 2.28 Favored 'General case' 0 C--O 1.204 -1.31 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -169.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.539 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 10.7 m-80 78.2 21.98 0.82 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 123.988 3.085 . . . . 0.0 113.889 -161.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -76.05 159.76 30.48 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.331 -0.855 . . . . 0.0 110.713 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -78.12 138.78 38.9 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 174.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.8 ttt -159.23 135.81 9.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.793 0.437 . . . . 0.0 109.919 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.329 51.9 m-85 58.07 21.56 8.01 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.79 7.24 88.37 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -124.18 -167.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.365 1.466 . . . . 0.0 108.459 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -138.4 151.19 47.25 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.546 0.338 . . . . 0.0 110.534 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -130.42 87.66 2.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.539 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.2 m120 -56.26 129.47 40.42 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 115.541 -2.171 . . . . 0.0 111.594 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.565 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.447 1.9 t -125.88 149.45 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 113.531 -3.268 . . . . 0.0 116.353 168.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 42.0 t -159.54 165.97 31.81 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.778 1.231 . . . . 0.0 108.166 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -71.38 148.63 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 22.2 t -85.34 161.98 19.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.017 0.527 . . . . 0.0 110.851 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -106.74 -0.23 23.7 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 117.515 0.143 . . . . 0.0 110.914 177.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -82.01 151.55 67.15 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.53 0.732 . . . . 0.0 110.317 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -77.43 -35.88 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.257 2.638 . . . . 0.0 112.208 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.76 158.84 9.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.352 0.661 . . . . 0.0 110.583 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.4 mt -79.96 146.71 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 81.9 mtp -119.25 130.14 25.01 Favored Pre-proline 0 N--CA 1.454 -0.253 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.87 163.81 34.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.632 2.888 . . . . 0.0 110.122 176.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.03 -125.04 1.71 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -72.43 166.62 22.21 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.948 0.499 . . . . 0.0 111.239 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 34.3 t -157.81 165.73 34.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.615 0.766 . . . . 0.0 109.773 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -125.62 -1.61 7.39 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.79 -178.8 51.83 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.005 0.336 . . . . 0.0 112.488 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 90.5 mt -143.77 160.53 40.56 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.964 0.906 . . . . 0.0 109.769 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.51 -12.0 61.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.752 0.421 . . . . 0.0 111.647 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -120.48 20.74 11.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.175 0.59 . . . . 0.0 110.29 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -169.77 -153.37 8.52 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.2 m -132.92 -15.44 2.63 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.2 t -127.06 146.25 50.43 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.753 0.421 . . . . 0.0 110.117 176.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.7 p -93.82 10.5 32.88 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.415 0.686 . . . . 0.0 110.874 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -135.61 147.92 48.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -156.77 154.24 29.63 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-O 120.704 0.288 . . . . 0.0 110.375 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 0.4 OUTLIER -132.63 140.19 48.09 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.888 0.875 . . . . 0.0 113.148 179.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.291 15.8 m-85 -111.03 8.61 21.96 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 117.638 2.458 . . . . 0.0 117.638 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.2 t -71.67 -28.68 63.9 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -92.5 -18.66 22.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.919 0.888 . . . . 0.0 111.289 178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 75.0 m -76.59 -17.78 59.01 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.93 2.24 0.97 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.66 1.184 . . . . 0.0 114.103 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -62.74 -15.4 53.05 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.462 -0.774 . . . . 0.0 112.862 -178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.21 124.62 17.58 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.81 0.444 . . . . 0.0 110.976 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -72.81 -33.52 66.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.62 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.328 57.9 m-85 -98.02 17.27 18.75 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.2 t -61.76 -22.11 65.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.48 152.05 74.1 Favored Pre-proline 0 C--N 1.339 0.134 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.68 -31.73 69.25 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.249 2.632 . . . . 0.0 112.43 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -78.86 -21.74 47.08 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 117.689 0.222 . . . . 0.0 111.091 -178.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -80.66 -41.95 22.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.84 -20.02 64.66 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.633 0.373 . . . . 0.0 111.912 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.42 -20.41 47.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.04 2.59 8.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -61.99 155.76 22.94 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.315 0.507 . . . . 0.0 111.934 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 18.4 mtt180 -141.92 131.57 24.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.5 mm -139.65 145.11 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 123.723 0.809 . . . . 0.0 109.001 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -158.29 159.22 35.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.152 0.581 . . . . 0.0 109.455 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -60.51 158.61 29.06 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -61.35 146.1 97.6 Favored 'Trans proline' 0 N--CA 1.451 -1.026 0 C-N-CA 122.292 1.995 . . . . 0.0 109.946 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -153.7 171.47 18.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -175.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -83.65 -7.88 59.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 1.9 t -85.46 141.92 13.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 174.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 11.7 tp -139.9 150.94 45.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.515 0.326 . . . . 0.0 110.209 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -125.01 150.06 47.1 Favored 'General case' 0 C--N 1.334 -0.106 0 C-N-CA 124.05 0.94 . . . . 0.0 108.848 -177.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -139.63 159.26 42.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.294 0.568 . . . . 0.0 111.952 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -150.42 166.34 30.39 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.3 m120 54.42 57.16 6.06 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.341 0.257 . . . . 0.0 111.215 -175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -129.34 150.61 76.02 Favored Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 122.455 0.302 . . . . 0.0 110.929 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . 0.428 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 52.2 Cg_exo -55.96 156.51 19.5 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.703 2.936 . . . . 0.0 113.014 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.27 -16.68 64.05 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.461 0.704 . . . . 0.0 111.058 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -122.67 24.3 9.2 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.89 0.876 . . . . 0.0 110.831 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.0 p -63.3 -13.16 12.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.575 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -55.37 -177.6 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 117.977 -1.011 . . . . 0.0 113.556 -165.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.575 ' H ' HG23 ' A' ' 510' ' ' THR . 22.8 pt-20 -21.29 -41.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -170.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.3 mt-10 -56.1 -48.75 75.54 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 117.413 -1.28 . . . . 0.0 114.413 172.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -87.07 -26.07 23.87 Favored 'General case' 0 C--N 1.35 0.61 0 CA-C-N 122.474 2.397 . . . . 0.0 106.886 -173.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -66.98 -38.22 85.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -73.39 -40.27 64.46 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -76.07 -22.82 55.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.483 -177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 55.8 mt -77.08 -45.31 30.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-N 118.417 0.553 . . . . 0.0 110.924 178.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 28.4 p -71.81 -27.58 63.02 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.599 -178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -71.7 -36.77 70.65 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.792 0.33 . . . . 0.0 111.499 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.61 -28.77 66.22 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.388 0.275 . . . . 0.0 111.307 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 91.4 mt -94.85 -5.63 44.59 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.658 0.383 . . . . 0.0 111.569 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.86 1.61 62.84 Favored Glycine 0 CA--C 1.531 1.052 0 CA-C-O 119.584 -0.564 . . . . 0.0 113.119 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.3 m -76.91 163.65 3.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 118.18 0.99 . . . . 0.0 112.941 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.43 144.97 53.22 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -83.43 144.18 45.86 Favored Pre-proline 0 N--CA 1.455 -0.215 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.154 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -70.17 151.61 66.82 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.303 2.668 . . . . 0.0 110.839 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -95.51 -17.61 21.31 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 176.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 27.8 t -152.42 159.79 43.35 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-O 120.597 0.237 . . . . 0.0 111.031 175.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 7.5 p -155.27 150.1 11.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 C-N-CA 123.184 0.593 . . . . 0.0 110.267 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -150.53 144.06 25.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.465 1.106 . . . . 0.0 108.8 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.21 151.94 31.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -156.61 -173.27 4.4 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -178.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 90.8 p -140.42 -177.47 5.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.011 0.924 . . . . 0.0 110.376 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.26 -8.97 62.91 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 123.839 0.733 . . . . 0.0 112.223 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.32 -28.26 21.15 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.95 0.875 . . . . 0.0 111.437 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.5 t -166.4 159.71 14.92 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.26 0.624 . . . . 0.0 110.057 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.08 -7.83 31.79 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.631 0.372 . . . . 0.0 110.296 175.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -79.77 -30.52 40.73 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.8 p -164.91 168.7 17.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.196 0.522 . . . . 0.0 112.057 -173.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 40.6 t -82.82 166.93 18.57 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.756 0.823 . . . . 0.0 110.325 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 62.7 m -142.65 159.23 42.64 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.349 1.06 . . . . 0.0 108.405 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.47 -174.16 46.66 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 119.834 -1.175 . . . . 0.0 113.415 -179.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.24 160.27 22.5 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.691 0.796 . . . . 0.0 110.699 -177.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 87.6 mt -142.03 162.47 35.41 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.572 1.549 . . . . 0.0 108.198 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -152.32 148.69 27.82 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.26 -0.275 . . . . 0.0 110.907 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 10.5 m-90 -126.41 175.27 7.99 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 125.228 1.411 . . . . 0.0 112.624 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -75.59 -9.78 58.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 42.0 t -161.38 158.09 26.31 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 122.852 0.461 . . . . 0.0 110.635 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.0 -21.01 63.26 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.361 0.264 . . . . 0.0 111.13 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.3 p -80.69 -24.83 38.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 117.929 0.331 . . . . 0.0 110.65 177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -76.26 -34.16 59.16 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.16 -26.29 59.01 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 175.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.1 tp -77.41 -35.75 53.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.726 0.41 . . . . 0.0 110.882 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.97 -37.58 75.82 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.9 m -72.77 -30.21 63.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -63.48 -33.83 76.44 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.0 -56.58 17.67 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 14.3 m-85 -82.38 -16.89 47.48 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -175.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.74 -13.95 14.91 Favored 'General case' 0 C--N 1.338 0.08 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -73.68 142.3 46.41 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.894 1.225 . . . . 0.0 108.995 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 60.67 10.55 2.67 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.49 1.116 . . . . 0.0 112.967 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 33.6 t80 -73.48 141.47 46.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -73.02 142.48 47.69 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' MET . . . . . 0.428 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 78.4 mtm -83.58 152.33 24.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.316 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -76.47 -20.26 57.18 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.335 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 38.11 77.67 0.4 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.529 1.132 . . . . 0.0 112.91 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.58 -1.53 9.3 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.789 2.993 . . . . 0.0 112.684 -174.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 36.4 p30 -143.52 1.41 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -90.57 154.78 23.57 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.71 -23.16 19.72 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 123.387 2.725 . . . . 0.0 110.957 177.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.06 154.0 29.26 Favored Pre-proline 0 CA--C 1.529 0.164 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.76 154.51 67.64 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 123.126 2.551 . . . . 0.0 111.704 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -130.01 142.45 50.63 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 102.887 -3.005 . . . . 0.0 102.887 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 145.87 50.85 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 116.064 1.876 . . . . 0.0 116.064 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.4 tt -100.96 153.95 19.09 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.891 1.276 . . . . 0.0 108.378 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.536 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -142.8 155.42 44.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 120.982 0.42 . . . . 0.0 111.042 179.82 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.44 162.91 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.57 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.0 p -159.24 164.86 34.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.473 0.709 . . . . 0.0 111.442 -172.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -56.53 123.51 15.06 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.1 t -77.43 145.65 37.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.268 0.8 OUTLIER -110.86 9.09 22.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 169.802 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.47 164.23 19.25 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.957 0.903 . . . . 0.0 111.112 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -90.75 1.31 56.99 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.939 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -177.41 176.58 1.29 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.531 1.132 . . . . 0.0 109.856 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -138.96 20.05 2.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.967 0.507 . . . . 0.0 111.226 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.248 -179.406 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 O4'-C1'-N19 112.117 3.917 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C5'-C4'-C3' 110.661 -3.226 . 0.393 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.535 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 O4'-C1'-N19 111.626 3.426 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.916 1 C5'-C4'-C3' 108.041 -4.973 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.763 1 O4'-C1'-N19 113.129 4.929 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.507 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.594 0 C5'-C4'-C3' 109.982 -3.679 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 O4'-C1'-N19 111.09 2.89 . 0.071 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.94 0 C3'-C2'-C1' 104.365 3.184 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.867 0 O4'-C1'-N19 111.09 2.89 . 0.217 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 1 C5'-C4'-C3' 108.113 -4.924 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.25 55.7 m-85 . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.61 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -68.32 168.92 18.1 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.111 3.208 . . . . 0.0 110.847 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -149.3 156.87 42.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.988 0.423 . . . . 0.0 110.74 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.58 162.39 29.27 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.901 0.48 . . . . 0.0 111.164 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -72.64 -8.0 53.13 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -178.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -159.64 148.53 14.02 Favored Pre-proline 0 N--CA 1.455 -0.221 0 C-N-CA 122.635 0.374 . . . . 0.0 110.948 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.57 -19.29 44.17 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.697 2.931 . . . . 0.0 111.56 172.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.79 148.56 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.0 tt -132.67 152.83 51.58 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.981 1.313 . . . . 0.0 108.372 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -135.96 132.44 36.39 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -175.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.38 153.6 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.441 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 2.5 m-85 -143.85 166.14 25.75 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 104.778 -2.304 . . . . 0.0 104.778 -178.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 91.62 11.3 60.82 Favored Glycine 0 CA--C 1.529 0.914 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 54.3 mt -81.19 35.11 0.38 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.934 0.894 . . . . 0.0 110.91 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.292 8.5 p30 -81.65 25.21 0.54 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -171.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -134.45 157.79 45.56 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 123.042 0.537 . . . . 0.0 110.684 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -69.08 -11.53 60.87 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.65 0.78 . . . . 0.0 112.962 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -80.31 -9.25 59.73 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.5 0.32 . . . . 0.0 111.563 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 61.6 mmm -96.23 144.26 26.59 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 118.021 0.373 . . . . 0.0 110.273 -177.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -159.51 153.22 22.86 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.5 p -58.54 -30.23 66.94 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -72.05 -41.84 66.99 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 177.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 84.6 mtt-85 -75.99 -44.97 37.06 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.731 0.301 . . . . 0.0 111.245 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.29 -41.73 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -174.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -73.63 -41.14 63.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . 0.497 ' HA ' ' SG ' ' A' ' 401' ' ' CYS . 3.9 p30 -66.56 -31.13 71.64 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.696 -0.802 . . . . 0.0 109.269 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.84 -60.77 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 107.186 -1.412 . . . . 0.0 107.186 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.481 0.6 OUTLIER -76.61 -20.48 56.7 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 118.936 2.939 . . . . 0.0 118.936 177.765 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . 0.497 ' SG ' ' HA ' ' A' ' 398' ' ' ASN . 2.8 p -81.64 -19.26 42.13 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.07 0.85 . . . . 0.0 111.139 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.5 pp -61.29 -15.2 32.88 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.978 0.808 . . . . 0.0 111.107 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -76.46 -8.12 56.51 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -171.14 -147.57 5.69 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 -175.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -88.22 159.88 17.95 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.712 0.405 . . . . 0.0 110.965 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.7 m -114.17 154.07 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -144.77 -74.66 0.24 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -149.05 167.58 25.48 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 -172.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 4.3 p -154.81 147.28 13.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 124.794 1.237 . . . . 0.0 108.551 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -157.04 133.37 9.81 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -81.39 168.32 18.49 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.942 1.83 . . . . 0.0 115.942 177.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 50.5 mtt -130.89 128.18 40.03 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-O 120.9 0.381 . . . . 0.0 111.6 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -5.94 55.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.832 0.853 . . . . 0.0 112.341 175.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.5 p -83.32 -7.25 59.61 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.331 0.652 . . . . 0.0 112.451 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.08 157.55 77.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 C-N-CA 123.86 0.864 . . . . 0.0 109.422 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.93 -14.25 43.0 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.26 2.64 . . . . 0.0 111.235 177.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.74 98.67 0.11 Allowed Glycine 0 C--N 1.338 0.645 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 175.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.84 158.17 36.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.36 0.664 . . . . 0.0 109.492 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.39 150.85 23.9 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.275 0.559 . . . . 0.0 112.231 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 34.6 ttm -96.57 151.8 19.25 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.559 1.144 . . . . 0.0 108.313 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 37.9 t -144.85 154.28 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -142.42 135.8 28.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 71.7 mtm -160.45 177.58 10.42 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.355 1.462 . . . . 0.0 108.987 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.61 125.5 24.47 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 171.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -72.3 -33.57 67.5 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.34 -84.43 0.04 OUTLIER Glycine 0 C--N 1.333 0.413 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -73.52 -29.32 62.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.25 -35.14 18.67 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.431 -174.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.43 -24.96 6.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.311 0 C-N-CA 118.916 -1.114 . . . . 0.0 109.828 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -70.33 -50.37 39.85 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.46 174.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -64.32 -36.05 82.86 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.623 -0.673 . . . . 0.0 112.032 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.63 -34.57 78.53 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.005 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -80.62 -8.04 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.528 0.731 . . . . 0.0 111.141 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 7.1 m -100.37 -18.87 16.56 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 176.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -131.89 -21.34 2.44 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -170.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 86.7 mt -134.43 -14.37 2.25 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.548 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.0 p-10 -71.65 100.86 2.39 Favored 'General case' 0 C--O 1.205 -1.285 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -170.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.525 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 22.7 m-80 77.07 21.94 1.06 Allowed 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 124.11 3.141 . . . . 0.0 112.526 -159.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -87.65 154.95 20.19 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 168.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -78.33 140.58 38.78 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -154.87 134.63 12.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.198 0.599 . . . . 0.0 110.272 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.388 48.4 m-85 59.43 19.09 7.44 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.93 10.73 62.46 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 120.017 -0.324 . . . . 0.0 112.446 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -146.14 150.18 35.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 117.411 0.606 . . . . 0.0 110.405 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -84.94 149.69 25.46 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.253 -0.279 . . . . 0.0 110.928 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -131.37 92.43 3.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.983 0.513 . . . . 0.0 109.636 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.525 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 21.5 t-20 -58.51 130.7 48.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 115.877 -2.011 . . . . 0.0 112.048 -171.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.548 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.451 2.2 t -124.88 149.7 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 113.46 -3.296 . . . . 0.0 116.416 168.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 34.4 t -161.39 172.91 15.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.162 1.385 . . . . 0.0 108.302 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.92 145.7 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 30.2 t -85.55 157.93 20.27 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 122.744 0.418 . . . . 0.0 110.877 177.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -96.57 -4.32 41.46 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.435 -0.166 . . . . 0.0 110.777 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -78.95 152.15 76.84 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.736 0.814 . . . . 0.0 111.111 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.13 -34.81 1.04 Allowed 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.56 2.84 . . . . 0.0 112.068 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.28 159.76 10.97 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 122.961 0.504 . . . . 0.0 111.107 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.3 mt -78.27 136.7 23.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 61.4 mmm -103.59 125.12 35.7 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 122.311 0.244 . . . . 0.0 110.975 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -78.16 173.31 14.1 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.904 3.07 . . . . 0.0 110.187 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 128.52 -108.57 0.92 Allowed Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -72.42 153.17 41.56 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.349 0.659 . . . . 0.0 110.679 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.2 p -159.04 175.22 13.8 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.28 0.632 . . . . 0.0 110.095 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -143.33 163.82 31.97 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.91 135.11 14.5 Favored Glycine 0 CA--C 1.525 0.659 0 O-C-N 122.099 -0.376 . . . . 0.0 112.66 -174.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.34 165.58 14.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.253 0.621 . . . . 0.0 109.516 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -72.7 -19.54 61.38 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.162 -0.336 . . . . 0.0 111.732 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -120.52 24.9 10.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.088 0.555 . . . . 0.0 109.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.2 -159.62 13.08 Favored Glycine 0 C--N 1.337 0.631 0 O-C-N 121.715 -0.616 . . . . 0.0 111.817 -177.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.5 t -133.09 -17.86 2.36 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.8 t -127.1 143.53 51.25 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.73 0.412 . . . . 0.0 110.04 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.6 p -86.74 1.59 51.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 123.168 0.587 . . . . 0.0 111.809 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.258 19.6 t80 -128.57 145.72 51.05 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 115.634 1.716 . . . . 0.0 115.634 -178.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -153.61 149.5 27.66 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.857 0.463 . . . . 0.0 109.952 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.251 0.1 OUTLIER -130.2 140.87 50.69 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 179.006 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.267 65.7 m-85 -111.75 -2.43 15.3 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -178.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 44.7 t -73.59 -26.31 60.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.13 14.99 2.06 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.699 0.8 . . . . 0.0 111.028 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 48.3 t -137.24 169.23 18.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.604 0.762 . . . . 0.0 110.56 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.04 6.49 31.2 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.111 0.565 . . . . 0.0 111.569 -176.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -62.06 -18.5 60.85 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.08 117.92 5.25 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.098 0.559 . . . . 0.0 111.657 -178.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -81.17 -33.59 32.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.277 62.3 m-85 -97.94 3.5 49.6 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -176.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 57.8 m -87.76 7.0 32.32 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -172.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' THR . . . . . 0.442 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.77 144.46 53.0 Favored Pre-proline 0 C--O 1.231 0.1 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 177.278 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.0 Cg_exo -64.66 -29.58 60.36 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.024 2.482 . . . . 0.0 112.372 -178.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -81.33 -26.4 35.66 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.667 -0.206 . . . . 0.0 111.18 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -82.25 -42.35 19.01 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.29 0.496 . . . . 0.0 110.906 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.35 -16.45 54.52 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.97 -21.52 33.98 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -124.04 4.13 8.64 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -64.02 155.44 31.14 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.779 0.718 . . . . 0.0 111.493 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -144.06 126.21 15.56 Favored 'General case' 0 N--CA 1.458 -0.062 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -174.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.8 mm -148.63 123.25 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 C-N-CA 124.351 1.06 . . . . 0.0 108.324 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -162.1 97.68 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.901 0.318 . . . . 0.0 110.781 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 15.1 p80 54.32 155.13 0.05 OUTLIER Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 127.501 2.32 . . . . 0.0 114.596 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.7 76.2 3.75 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.536 2.824 . . . . 0.0 109.837 176.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.1 t -65.01 161.0 19.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.129 0.572 . . . . 0.0 110.856 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -83.84 -7.41 59.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 5.0 t -85.32 148.7 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.952 0.901 . . . . 0.0 110.8 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 10.2 tp -136.59 151.57 49.5 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -123.25 146.21 48.04 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -140.13 155.64 46.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.459 0.647 . . . . 0.0 109.34 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -148.44 163.77 36.15 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 104.423 -2.436 . . . . 0.0 104.423 -174.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 60.94 57.23 2.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.733 0.813 . . . . 0.0 112.044 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -137.39 137.09 21.42 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.945 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -49.83 159.91 1.42 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.863 3.042 . . . . 0.0 113.038 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.524 HD11 ' H ' ' A' ' 507' ' ' LEU . 2.9 mp -68.52 -16.5 63.9 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -173.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.6 19.93 11.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 15.2 m -71.55 5.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.581 HG21 ' H ' ' A' ' 511' ' ' GLU . 0.8 OUTLIER -54.88 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 117.497 -1.24 . . . . 0.0 113.223 -167.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.581 ' H ' HG21 ' A' ' 510' ' ' THR . 23.2 pt-20 -23.64 -37.29 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -171.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 92.9 mt-10 -56.85 -49.74 74.56 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 117.416 -1.278 . . . . 0.0 114.009 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -85.1 -25.75 27.34 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 122.286 2.312 . . . . 0.0 106.69 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -65.87 -38.37 88.61 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -74.44 -42.12 59.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.47 -24.64 59.07 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.094 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -74.48 -38.68 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.27 0.486 . . . . 0.0 109.983 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 93.5 m -67.41 -36.61 81.61 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 122.023 -0.423 . . . . 0.0 110.863 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -69.62 -29.18 66.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -76.58 -27.36 55.81 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 122.15 0.18 . . . . 0.0 111.186 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 80.1 mt -96.07 -6.06 39.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.893 0.477 . . . . 0.0 111.62 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.47 -8.57 25.81 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-O 119.472 -0.627 . . . . 0.0 113.195 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 m -76.92 155.37 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 118.384 1.092 . . . . 0.0 112.022 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -68.54 151.12 47.22 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.297 0.57 . . . . 0.0 112.024 -173.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -71.94 155.04 92.4 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.984 0.913 . . . . 0.0 111.286 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.24 155.1 65.12 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.387 2.725 . . . . 0.0 110.949 175.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -88.38 -20.57 25.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 14.1 t -153.91 164.03 39.08 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 110.994 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 3.1 p -160.34 146.81 5.93 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 C-N-CA 123.119 0.568 . . . . 0.0 109.469 -176.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -143.23 137.8 29.2 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.166 0.986 . . . . 0.0 108.929 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.2 146.99 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.343 0.657 . . . . 0.0 110.834 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -155.38 174.84 14.66 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 -173.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 80.8 p -62.93 134.78 56.73 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.503 0.668 . . . . 0.0 110.347 177.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -70.84 163.96 53.49 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.502 -175.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -81.05 12.13 3.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.411 1.084 . . . . 0.0 111.5 177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 30.2 t -155.38 -172.73 4.27 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.335 1.054 . . . . 0.0 108.968 -177.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.85 -7.88 32.36 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -89.55 110.4 21.25 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.428 0.691 . . . . 0.0 110.593 172.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 68.2 m 53.6 -163.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.882 0.873 . . . . 0.0 112.954 174.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 20.7 m -140.8 178.49 7.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.523 1.129 . . . . 0.0 110.896 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.8 m -137.6 168.56 19.42 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . -174.88 179.32 46.26 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.669 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -121.75 158.4 28.87 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.729 0.812 . . . . 0.0 109.864 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.1 mt -141.26 166.7 24.05 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 124.728 1.211 . . . . 0.0 109.385 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -153.85 150.74 28.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.193 -0.317 . . . . 0.0 110.708 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 20.8 m-90 -130.54 165.52 22.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.792 1.237 . . . . 0.0 111.638 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -68.17 -7.04 26.63 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.2 t -160.13 160.92 33.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.559 0.344 . . . . 0.0 110.794 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -67.46 -27.96 67.47 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 177.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.0 m -76.95 -26.58 54.18 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.462 0.305 . . . . 0.0 110.727 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.19 -36.89 66.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 177.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.95 -24.55 52.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 175.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.9 tp -78.79 -36.81 42.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.895 0.478 . . . . 0.0 111.481 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -75.22 -38.73 60.55 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.85 -24.41 64.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.33 -33.7 73.52 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.42 -27.03 73.26 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.34 9.1 m-85 -100.31 -6.11 26.39 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 118.961 2.949 . . . . 0.0 118.961 177.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.6 mt -123.9 -9.42 7.76 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -73.36 139.69 46.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.838 1.199 . . . . 0.0 109.356 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 56.19 17.44 2.76 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.311 1.045 . . . . 0.0 112.719 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -70.32 138.94 51.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -74.42 129.55 37.98 Favored 'General case' 0 N--CA 1.455 -0.185 0 O-C-N 122.195 -0.315 . . . . 0.0 111.083 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.9 mtm -83.53 152.45 24.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.569 0.223 . . . . 0.0 111.122 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -74.31 -16.74 60.92 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.933 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 40.91 80.47 0.28 Allowed Pre-proline 0 CA--C 1.533 0.311 0 C-N-CA 125.752 1.621 . . . . 0.0 112.476 177.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -73.56 9.09 1.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 124.018 3.145 . . . . 0.0 112.165 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -139.02 21.47 2.63 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -176.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -157.37 159.9 30.12 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 122.088 -0.382 . . . . 0.0 112.726 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.03 -16.45 20.14 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 124.715 3.61 . . . . 0.0 112.909 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.262 4.7 p90 -144.31 148.97 43.03 Favored Pre-proline 0 CA--C 1.528 0.104 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.4 157.06 57.51 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.588 2.859 . . . . 0.0 112.264 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.87 142.46 50.66 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 102.807 -3.035 . . . . 0.0 102.807 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -73.35 137.56 44.81 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -86.3 138.25 31.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.928 1.291 . . . . 0.0 108.145 175.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.535 ' HZ1' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -127.99 146.57 50.62 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.597 0.635 . . . . 0.0 110.458 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.3 161.29 39.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.091 0.472 . . . . 0.0 111.281 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.53 172.14 14.85 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.039 0.935 . . . . 0.0 110.166 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -54.99 121.96 9.85 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.434 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 32.1 t -78.65 152.33 31.75 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.4 t -118.61 10.64 12.59 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 170.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.33 162.49 14.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.47 0.652 . . . . 0.0 111.867 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -82.99 8.88 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.894 0.878 . . . . 0.0 112.741 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -160.2 178.11 9.98 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.475 0.579 . . . . 0.0 111.31 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.51 12.43 1.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.085 0.954 . . . . 0.0 110.112 169.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.39 -1.29 . . . . 0.0 110.401 -176.391 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.441 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 O4'-C1'-N19 112.16 3.96 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.782 0 C5'-C4'-C3' 110.446 -3.37 . 0.4 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.565 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 O4'-C1'-N19 111.797 3.597 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 1 C5'-C4'-C3' 108.942 -4.372 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.936 1 O4'-C1'-N19 112.844 4.644 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.542 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 C5'-C4'-C3' 109.652 -3.898 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 O4'-C1'-N19 111.496 3.296 . 0.021 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.074 0 C3'-C2'-C1' 104.722 3.58 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.434 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O4'-C1'-N19 111.007 2.807 . 0.23 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 1 O4'-C1'-N19 112.897 4.697 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.282 17.5 t80 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -179.35 173.22 45.22 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.07 176.3 7.95 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.408 3.405 . . . . 0.0 110.84 177.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -147.3 153.37 39.65 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 122.836 0.455 . . . . 0.0 110.719 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -76.28 159.47 30.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.767 0.427 . . . . 0.0 110.714 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -82.44 1.48 37.3 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.4 t -157.77 145.38 13.72 Favored Pre-proline 0 N--CA 1.456 -0.174 0 C-N-CA 122.83 0.452 . . . . 0.0 110.69 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.54 -15.05 41.04 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.661 2.907 . . . . 0.0 110.676 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 t -88.93 149.0 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.57 155.88 47.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.253 1.021 . . . . 0.0 108.429 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.1 tpt -139.37 133.76 31.55 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 122.01 -0.431 . . . . 0.0 110.808 -174.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.16 153.53 37.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.446 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 6.9 m-85 -139.48 166.45 24.53 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 90.68 9.48 64.37 Favored Glycine 0 CA--C 1.529 0.954 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.659 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.8 mt -78.1 25.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.77 0.785 . . . . 0.0 112.483 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -67.49 -15.57 63.74 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -72.21 155.36 40.31 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.644 -0.66 . . . . 0.0 111.958 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.8 p -68.72 -9.17 48.98 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 123.591 0.756 . . . . 0.0 111.328 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -95.63 5.08 52.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.723 0.809 . . . . 0.0 111.254 -173.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 59.1 mmm -106.33 138.14 43.04 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -177.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -160.18 157.98 29.3 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.443 0.697 . . . . 0.0 109.863 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 92.9 m -52.27 -41.76 63.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.58 0.352 . . . . 0.0 111.668 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -72.17 -36.51 69.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -76.02 -47.25 25.58 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -174.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 18.6 t -69.75 -40.78 79.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.404 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 3.6 t80 -78.27 -31.34 49.01 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.009 -170.045 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -74.66 -31.05 61.81 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 119.897 1.226 . . . . 0.0 109.84 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.78 -56.48 17.58 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.556 2.3 p90 -76.55 -3.79 39.36 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 174.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 35.7 t -75.05 -35.11 61.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 122.07 -0.394 . . . . 0.0 111.357 177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.4 -15.46 36.85 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -80.69 -7.18 59.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.91 2.189 . . . . 0.0 116.91 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -179.54 -130.64 1.49 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 118.289 0.495 . . . . 0.0 111.963 -175.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -136.49 124.15 22.38 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.404 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.4 m -114.02 165.46 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -174.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -118.04 -61.49 1.67 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -154.38 166.16 34.09 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.5 p -145.57 152.03 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 C-N-CA 124.604 1.162 . . . . 0.0 109.828 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -155.62 131.84 10.16 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.254 3.3 m-85 -82.73 164.03 20.92 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 116.871 2.175 . . . . 0.0 116.871 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.8 mmt -106.7 120.4 41.89 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.336 0.654 . . . . 0.0 112.44 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -79.1 -20.52 48.5 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.625 0.77 . . . . 0.0 111.31 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 42.3 t -81.45 -19.51 42.25 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.061 0.545 . . . . 0.0 112.355 -175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -115.64 157.87 43.28 Favored Pre-proline 0 N--CA 1.456 -0.156 0 C-N-CA 123.371 0.669 . . . . 0.0 109.759 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 -18.55 55.9 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.712 2.275 . . . . 0.0 110.791 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.64 103.82 0.17 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 176.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.36 162.37 33.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.802 0.841 . . . . 0.0 109.194 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.13 147.0 16.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 112.067 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 80.2 mtp -90.02 152.82 21.0 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.308 170.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.63 152.56 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 123.603 0.761 . . . . 0.0 110.228 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -136.31 130.35 32.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.595 0.634 . . . . 0.0 109.84 175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.0 mtp -151.0 171.22 17.63 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.449 0.7 . . . . 0.0 109.14 -169.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.52 123.27 19.2 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -72.61 -33.43 66.67 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -167.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.9 -88.66 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -72.27 -26.47 62.0 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -175.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -90.15 -34.23 15.94 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.265 -174.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.18 -24.44 6.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 118.096 -1.442 . . . . 0.0 109.155 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -67.6 -50.41 58.38 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.527 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -65.18 -38.88 91.9 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.53 -37.51 85.17 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.785 0.72 . . . . 0.0 109.987 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 57.8 mt -77.45 -9.08 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.453 0.701 . . . . 0.0 111.713 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 76.7 m -102.85 -15.52 16.19 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -133.11 -24.81 1.84 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 -169.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.5 mp -133.98 -12.33 2.55 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.385 1.448 . . . . 0.0 113.329 -172.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.558 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -70.97 101.15 2.12 Favored 'General case' 0 C--O 1.206 -1.208 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -169.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.551 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 13.1 m-80 77.1 22.07 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 124.518 3.326 . . . . 0.0 113.669 -161.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.12 162.94 20.1 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 167.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -81.21 138.61 35.8 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.3 ttt -153.74 137.85 16.45 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.46 0.704 . . . . 0.0 109.71 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.5 m-85 57.46 21.53 7.07 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.95 7.33 66.15 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.44 -0.644 . . . . 0.0 113.089 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -149.91 154.27 38.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.03 0.915 . . . . 0.0 110.579 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -73.96 146.21 44.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.996 0.518 . . . . 0.0 111.818 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -125.12 84.45 2.28 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.243 1.017 . . . . 0.0 108.814 175.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.551 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 7.5 m120 -55.16 128.39 33.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.756 -170.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.558 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.0 t -126.99 149.0 31.76 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 C-N-CA 113.486 -3.286 . . . . 0.0 115.848 168.545 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.6 t -160.28 170.7 20.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.554 1.542 . . . . 0.0 107.763 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.1 148.87 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 20.6 t -83.36 166.47 18.41 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 122.983 0.513 . . . . 0.0 110.634 177.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.86 11.69 10.41 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -85.15 152.84 59.14 Favored Pre-proline 0 CA--C 1.532 0.259 0 C-N-CA 123.46 0.704 . . . . 0.0 110.22 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -65.49 -46.57 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.888 2.392 . . . . 0.0 112.468 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -170.02 160.29 8.13 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.902 0.881 . . . . 0.0 109.751 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.8 mt -77.91 143.08 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.2 mtp -114.16 134.12 22.26 Favored Pre-proline 0 N--CA 1.454 -0.236 0 O-C-N 122.407 -0.183 . . . . 0.0 111.033 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.38 161.47 40.17 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.497 2.798 . . . . 0.0 109.282 174.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 159.76 -132.15 2.91 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -72.47 161.79 30.34 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.892 0.477 . . . . 0.0 110.021 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.0 p -149.3 168.78 22.4 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.341 0.656 . . . . 0.0 110.03 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -129.34 -1.25 5.05 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.49 -178.95 46.98 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 -178.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.79 159.43 42.88 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.162 0.985 . . . . 0.0 109.453 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -76.7 -9.28 58.56 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -120.62 24.93 10.05 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.611 0.764 . . . . 0.0 110.249 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.89 -152.97 9.34 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.0 m -133.01 -12.67 2.85 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 178.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 19.4 p -127.04 150.86 49.25 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.274 0.63 . . . . 0.0 111.924 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.2 p -99.8 4.74 45.44 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.334 0.653 . . . . 0.0 110.884 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -141.6 148.24 38.91 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.374 1.47 . . . . 0.0 113.574 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -151.08 156.15 40.45 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 118.274 0.488 . . . . 0.0 111.291 -176.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -127.96 137.08 52.12 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -129.92 -1.78 4.69 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -68.22 -30.59 69.69 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.643 0.377 . . . . 0.0 111.749 -174.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -91.19 -2.72 57.45 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.683 0.393 . . . . 0.0 111.418 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 46.3 t -96.3 151.31 19.64 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.821 0.449 . . . . 0.0 111.927 -176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -90.97 5.3 49.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.874 0.47 . . . . 0.0 111.183 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.05 -22.3 65.64 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.678 0.391 . . . . 0.0 111.656 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -60.71 137.7 58.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.905 0.482 . . . . 0.0 109.917 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -72.12 -24.75 61.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.16 -175.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.269 51.8 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 88.6 p -61.19 -22.16 64.49 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -169.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.59 157.72 67.44 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.48 -23.8 75.11 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.876 2.384 . . . . 0.0 111.298 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -80.96 -31.78 34.7 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -76.97 -28.11 55.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -73.45 -21.38 60.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 122.652 0.381 . . . . 0.0 110.72 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.9 -12.97 58.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.879 0.472 . . . . 0.0 111.895 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -123.97 16.53 9.3 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.966 0.507 . . . . 0.0 110.676 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 149.17 48.58 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 111.41 -174.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -145.6 130.46 18.17 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 30.1 mm -140.53 137.54 36.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 122.777 0.431 . . . . 0.0 110.153 -175.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -152.26 167.42 28.66 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.44 1.096 . . . . 0.0 109.624 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -64.74 157.61 73.38 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.63 148.61 92.63 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.37 2.047 . . . . 0.0 109.584 178.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -152.46 174.72 13.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -83.82 -7.66 59.4 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -86.76 140.24 16.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 112.328 173.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 14.4 tp -137.56 142.72 41.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -112.32 150.93 30.33 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.783 0.833 . . . . 0.0 109.406 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -146.46 160.22 42.37 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.456 0.646 . . . . 0.0 109.646 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -151.63 167.55 27.77 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 32.8 m120 53.28 55.71 8.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.612 0.365 . . . . 0.0 111.427 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.22 152.85 52.92 Favored Pre-proline 0 CA--C 1.531 0.217 0 C-N-CA 122.323 0.249 . . . . 0.0 110.454 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.15 152.4 38.06 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.152 2.568 . . . . 0.0 112.157 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.78 -16.4 63.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.97 0.508 . . . . 0.0 112.203 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -122.06 24.62 9.45 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.615 0.766 . . . . 0.0 110.897 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.74 -13.23 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 -176.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.563 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.3 -178.37 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -166.484 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.563 ' H ' HG23 ' A' ' 510' ' ' THR . 23.0 pt-20 -20.23 -42.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.6 mt-10 -56.15 -49.24 74.52 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 172.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -87.17 -27.04 23.26 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 122.034 2.197 . . . . 0.0 106.732 -173.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -64.95 -39.92 94.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -70.53 -44.42 67.55 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -75.31 -26.56 58.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.085 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.3 mt -71.6 -37.38 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.044 0 CA-C-N 118.858 0.754 . . . . 0.0 110.203 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 94.5 m -67.3 -29.97 69.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.897 -0.502 . . . . 0.0 111.026 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -73.85 -28.98 61.86 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -78.36 -11.51 59.95 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.98 -4.88 12.52 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.173 0.589 . . . . 0.0 111.55 -179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.8 3.87 60.57 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 123.572 0.606 . . . . 0.0 112.82 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.94 157.13 5.46 Favored 'Isoleucine or valine' 0 C--N 1.339 0.129 0 CA-C-N 117.831 0.815 . . . . 0.0 112.813 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.53 144.5 55.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.575 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 55.3 ptt85 -80.81 149.43 67.32 Favored Pre-proline 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.63 148.3 65.57 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 123.058 2.505 . . . . 0.0 110.311 177.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.7 t -85.64 -21.01 28.62 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -146.84 154.64 41.57 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 122.978 0.511 . . . . 0.0 110.786 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 76.8 t -144.72 145.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 123.649 0.779 . . . . 0.0 109.913 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -152.85 143.63 22.85 Favored 'General case' 0 C--N 1.337 0.049 0 C-N-CA 123.002 0.521 . . . . 0.0 109.994 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -138.62 150.64 23.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.057 0 C-N-CA 123.43 0.692 . . . . 0.0 112.13 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -154.85 -178.72 7.42 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -178.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.8 t -134.06 -177.76 4.72 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.307 1.043 . . . . 0.0 109.77 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 99.76 9.82 48.44 Favored Glycine 0 CA--C 1.527 0.826 0 CA-C-O 119.746 -0.474 . . . . 0.0 111.97 -177.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -125.67 -26.07 3.58 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 117.659 0.729 . . . . 0.0 112.5 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.3 t -164.52 155.09 14.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.812 0.445 . . . . 0.0 110.587 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -103.43 -8.05 20.48 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.038 0.535 . . . . 0.0 110.532 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -78.47 -38.42 41.06 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 122.723 0.409 . . . . 0.0 112.055 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 58.4 m -156.06 167.7 29.57 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 111.399 -171.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -83.8 167.52 17.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.644 0.778 . . . . 0.0 110.825 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -151.52 160.21 43.79 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 124.322 1.049 . . . . 0.0 108.616 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.05 -168.46 41.6 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.833 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.02 160.27 22.32 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.507 0.723 . . . . 0.0 110.827 -179.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.4 mt -138.06 161.76 35.92 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.268 1.427 . . . . 0.0 107.921 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -151.64 147.41 26.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.244 -0.285 . . . . 0.0 110.873 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -125.03 173.54 8.62 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.722 1.209 . . . . 0.0 112.723 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -74.68 -7.55 53.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.8 t -158.98 158.26 32.89 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 122.484 0.314 . . . . 0.0 111.119 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -68.05 -27.91 66.93 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.501 0.32 . . . . 0.0 110.532 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 85.3 p -77.08 -23.77 51.89 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.273 0.229 . . . . 0.0 110.839 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -76.82 -35.51 57.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.248 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.19 -28.49 61.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 122.187 -0.321 . . . . 0.0 110.353 174.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.4 tp -73.09 -42.98 62.42 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.061 0.544 . . . . 0.0 111.17 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -70.2 -35.3 73.83 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.82 -21.85 63.35 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.57 -39.19 88.36 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.07 -26.94 73.63 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.761 -0.466 . . . . 0.0 112.309 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.347 10.6 m-85 -102.16 -1.23 31.83 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 119.437 3.125 . . . . 0.0 119.437 179.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 60.4 mt -135.79 -4.59 2.23 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.828 1.195 . . . . 0.0 114.137 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.92 143.89 47.54 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 119.962 1.255 . . . . 0.0 109.094 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.87 15.41 3.85 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.369 1.068 . . . . 0.0 113.341 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -70.06 139.04 52.55 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -73.93 136.9 43.33 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.822 -0.549 . . . . 0.0 111.942 -175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.4 mtm -83.57 152.56 24.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.894 0.478 . . . . 0.0 110.676 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -71.97 168.19 18.54 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -146.55 121.22 5.32 Favored Pre-proline 0 N--CA 1.454 -0.264 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.9 -22.74 31.02 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.106 2.538 . . . . 0.0 113.306 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -158.71 -5.95 0.08 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 114.544 1.312 . . . . 0.0 114.544 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -73.92 158.98 52.57 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.828 0.74 . . . . 0.0 111.714 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.87 -21.28 21.41 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.058 3.172 . . . . 0.0 112.396 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -152.63 151.82 27.59 Favored Pre-proline 0 N--CA 1.456 -0.171 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.66 165.26 30.66 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.933 3.089 . . . . 0.0 111.414 177.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.91 142.35 50.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 102.825 -3.028 . . . . 0.0 102.825 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.7 143.53 42.07 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.4 tt -89.05 152.22 21.8 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.601 1.16 . . . . 0.0 108.95 173.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.488 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -139.95 150.75 44.9 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.023 -0.423 . . . . 0.0 110.777 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.27 162.05 40.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 22.3 p -165.49 168.27 16.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -54.94 129.58 38.21 Favored 'General case' 0 N--CA 1.457 -0.09 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.7 t -81.16 148.57 29.51 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -114.04 8.21 17.0 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 169.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.98 158.91 21.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.068 0.947 . . . . 0.0 111.744 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -91.84 -3.41 56.1 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.489 -178.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -154.53 172.77 17.27 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.553 0.741 . . . . 0.0 110.541 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.97 23.36 1.37 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.972 0.909 . . . . 0.0 109.802 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.253 1.255 0 CA-C-O 117.427 -1.273 . . . . 0.0 110.515 -176.416 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.446 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.418 -2.878 1 O4'-C1'-N19 112.821 4.621 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C5'-C4'-C3' 110.261 -3.493 . 0.402 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.559 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C3'-C2'-C1' 104.633 3.481 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 1 C5'-C4'-C3' 107.854 -5.097 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.745 1 O4'-C1'-N19 113.56 5.36 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.485 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C5'-C4'-C3' 109.868 -3.754 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . 0.405 " C1'" ' HE2' ' A' ' 576' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 O4'-C1'-N19 111.164 2.964 . 0.077 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.951 0 C3'-C2'-C1' 105.065 3.961 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.872 0 O4'-C1'-N19 110.796 2.596 . 0.122 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 1 C5'-C4'-C3' 108.592 -4.605 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.3 31.4 t80 . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 115.594 1.702 . . . . 0.0 115.594 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -69.42 173.69 36.21 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 112.387 -0.285 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.7 179.6 4.08 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 124.772 3.648 . . . . 0.0 110.942 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -142.99 157.24 44.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.89 0.476 . . . . 0.0 110.765 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.97 158.93 34.5 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.514 0.725 . . . . 0.0 110.948 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -73.74 -4.39 34.27 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -158.08 147.91 15.33 Favored Pre-proline 0 N--CA 1.456 -0.131 0 C-N-CA 123.177 0.591 . . . . 0.0 110.035 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.27 -15.22 47.47 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.908 2.406 . . . . 0.0 110.322 174.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.5 t -91.26 154.79 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.583 0.753 . . . . 0.0 112.752 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.8 tt -140.41 152.07 45.42 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 125.152 1.381 . . . . 0.0 108.297 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -134.8 134.34 40.76 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.452 0.301 . . . . 0.0 111.033 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -129.91 152.71 37.78 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.069 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.441 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 3.7 m-85 -142.96 173.75 11.28 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -178.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 86.62 11.29 71.56 Favored Glycine 0 CA--C 1.527 0.808 0 O-C-N 122.242 -0.286 . . . . 0.0 112.48 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 41.2 mt -76.3 39.68 0.2 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.739 0.816 . . . . 0.0 110.998 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -74.34 18.67 0.15 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -136.98 156.27 48.65 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.943 0.497 . . . . 0.0 111.439 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 36.6 t -69.19 -15.38 63.38 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.52 0.728 . . . . 0.0 111.883 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -74.28 5.01 4.91 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 91.0 mmm -114.18 141.37 47.6 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.301 0.501 . . . . 0.0 110.782 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -162.36 168.02 22.83 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.568 1.147 . . . . 0.0 108.963 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 95.1 m -54.83 -32.11 60.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.902 0.481 . . . . 0.0 111.981 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.36 -38.6 60.0 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -66.39 -48.3 70.55 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -177.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.23 -49.41 84.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.451 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.268 1.4 m-85 -61.14 -56.87 15.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 178.025 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -57.44 -33.81 68.31 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.792 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.21 -64.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.572 0.5 OUTLIER -76.56 -5.52 48.01 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 176.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 50.5 t -74.77 -32.24 62.0 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.5 pp -63.3 -17.6 62.71 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.629 172.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -91.73 -8.83 45.8 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.73 -179.26 41.7 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 118.375 0.534 . . . . 0.0 112.455 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -80.67 129.99 34.84 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 122.599 -0.353 . . . . 0.0 110.958 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.451 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 0.8 OUTLIER -114.05 165.55 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.451 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -129.29 -63.34 0.95 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -154.42 158.81 40.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.295 0.952 . . . . 0.0 113.157 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . 0.416 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.5 p -138.52 150.94 24.09 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 C-N-CA 123.908 0.883 . . . . 0.0 110.267 -175.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -150.78 122.14 7.86 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.964 0.906 . . . . 0.0 110.417 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.259 6.6 m-85 -80.51 155.43 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 177.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 mmt -100.26 115.96 31.13 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.783 0.433 . . . . 0.0 110.949 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -79.15 -14.26 59.21 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.69 0.396 . . . . 0.0 111.341 172.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.7 p -85.0 -5.48 59.35 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.322 0.649 . . . . 0.0 112.251 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -126.21 156.73 71.83 Favored Pre-proline 0 CA--C 1.529 0.153 0 C-N-CA 123.554 0.741 . . . . 0.0 109.903 -177.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.63 -15.06 40.77 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.189 2.593 . . . . 0.0 111.592 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.19 92.07 0.08 OUTLIER Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.99 159.72 41.75 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.38 166.7 32.65 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.276 0.56 . . . . 0.0 110.578 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 41.1 ttp -129.49 147.43 51.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.275 1.03 . . . . 0.0 109.065 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.67 157.05 20.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -137.17 133.83 35.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 26.3 mtm -153.02 177.96 10.22 Favored 'General case' 0 C--O 1.23 0.078 0 C-N-CA 123.934 0.894 . . . . 0.0 109.957 -173.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.09 118.64 10.13 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 171.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -72.3 -33.3 67.3 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -168.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.69 -86.21 0.02 OUTLIER Glycine 0 C--N 1.335 0.524 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -177.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -74.5 -28.53 61.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.81 -34.06 18.4 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.984 -174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.4 t -88.76 -23.99 6.17 Favored 'Isoleucine or valine' 0 C--N 1.341 0.225 0 C-N-CA 118.828 -1.149 . . . . 0.0 109.47 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.83 -52.06 33.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.943 174.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -68.17 -32.7 73.13 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 121.874 -0.516 . . . . 0.0 112.386 -176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.67 -34.19 75.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 118.721 0.691 . . . . 0.0 110.584 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.53 -12.69 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.31 0.644 . . . . 0.0 110.731 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.7 m -92.42 -21.24 20.31 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -128.6 -28.17 2.53 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.72 -15.16 7.99 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 120.486 1.494 . . . . 0.0 114.447 -172.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.555 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.63 100.82 2.38 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 116.83 2.159 . . . . 0.0 116.83 -167.59 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.584 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 12.1 m-80 76.84 21.95 1.14 Allowed 'General case' 0 N--CA 1.482 1.144 0 O-C-N 117.743 -3.098 . . . . 0.0 113.199 -161.464 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -81.03 163.13 23.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.873 -1.142 . . . . 0.0 108.769 167.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -82.62 140.94 32.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.9 ttt -159.7 138.7 10.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.09 0.556 . . . . 0.0 110.15 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.419 46.4 m-85 57.03 20.71 5.64 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.91 70.67 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -134.19 -167.58 1.98 Allowed 'General case' 0 C--O 1.231 0.092 0 C-N-CA 124.326 1.05 . . . . 0.0 108.866 177.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -129.71 143.08 50.65 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.8 ptm -118.02 84.59 2.2 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.991 0.517 . . . . 0.0 110.393 -177.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.584 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 2.7 m-20 -54.44 128.4 31.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.779 -173.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.555 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.441 2.3 t -126.19 154.38 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 113.286 -3.366 . . . . 0.0 115.848 168.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 45.8 t -162.99 166.79 23.34 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.477 1.511 . . . . 0.0 108.716 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 10.2 t -68.61 145.16 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 O-C-N 121.855 -0.528 . . . . 0.0 112.084 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.4 t -84.41 155.99 22.01 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.635 0.374 . . . . 0.0 111.144 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.412 ' HE3' ' C6 ' ' B' ' 2' ' ' ' C' . 16.5 ptpt -96.54 -9.62 29.1 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.51 -0.119 . . . . 0.0 110.711 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -76.31 148.51 80.77 Favored Pre-proline 0 N--CA 1.454 -0.264 0 C-N-CA 123.404 0.682 . . . . 0.0 110.658 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.22 -32.87 3.79 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.364 2.71 . . . . 0.0 111.617 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.81 157.89 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.286 0.634 . . . . 0.0 110.671 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 17.7 mt -82.58 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 49.7 mmm -93.9 119.78 66.54 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 122.476 0.31 . . . . 0.0 110.382 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.49 154.47 45.13 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.213 2.609 . . . . 0.0 109.337 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 154.53 -113.06 0.55 Allowed Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.38 163.49 27.91 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.499 0.666 . . . . 0.0 111.905 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 14.7 t -157.37 160.12 38.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.44 1.096 . . . . 0.0 109.632 -177.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -130.07 0.73 4.72 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.39 175.07 44.76 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 93.8 mt -143.41 157.03 44.79 Favored 'General case' 0 N--CA 1.458 -0.074 0 C-N-CA 124.235 1.014 . . . . 0.0 109.179 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -75.6 -8.04 55.77 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . 0.253 11.9 t0 -120.49 26.89 8.89 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 122.039 0.923 . . . . 0.0 112.665 175.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.51 -150.83 7.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 69.4 m -133.05 -16.9 2.45 Favored 'General case' 0 N--CA 1.458 -0.07 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.9 m -127.04 149.14 50.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.863 0.465 . . . . 0.0 111.368 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.9 p -89.77 7.19 38.15 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 110.137 173.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -139.77 148.64 42.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.993 1.317 . . . . 0.0 113.275 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -154.7 158.2 39.23 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.05 0.387 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -127.7 136.65 51.86 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -134.07 4.66 3.52 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -179.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -64.85 -22.01 66.91 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.127 0.571 . . . . 0.0 112.046 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -114.02 1.21 14.59 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.05 0.54 . . . . 0.0 111.777 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.9 m -75.73 149.81 37.96 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.023 0.44 . . . . 0.0 111.53 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -80.12 -11.14 59.78 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.157 0.583 . . . . 0.0 111.151 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -62.05 -23.93 66.78 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.155 0.582 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -60.89 128.68 37.68 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.832 0.453 . . . . 0.0 110.27 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -73.18 -33.64 65.54 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.349 61.0 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -63.87 -21.95 66.69 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -173.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -135.19 150.5 72.95 Favored Pre-proline 0 C--O 1.23 0.071 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.6 -25.45 24.69 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.24 2.627 . . . . 0.0 111.412 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -80.03 -22.55 42.26 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.01 -0.431 . . . . 0.0 110.509 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -82.21 -41.65 20.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 172.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.26 -20.08 63.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.653 0.381 . . . . 0.0 111.858 -178.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.65 -19.71 48.45 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.472 0.309 . . . . 0.0 111.759 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -123.97 2.25 8.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -61.44 156.34 19.5 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.482 0.583 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -140.03 137.13 34.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -175.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.3 mm -141.12 144.02 27.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 123.595 0.758 . . . . 0.0 109.119 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -147.93 167.87 23.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.554 0.741 . . . . 0.0 111.086 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -63.0 155.36 73.07 Favored Pre-proline 0 N--CA 1.455 -0.196 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 172.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -66.01 135.49 41.0 Favored 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.191 1.927 . . . . 0.0 108.456 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -154.12 173.71 15.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.77 0.428 . . . . 0.0 110.076 -172.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -83.79 -8.77 59.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.7 -0.19 . . . . 0.0 111.161 -178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.64 138.04 20.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.2 tp -139.18 151.22 46.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -123.02 149.37 44.44 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.771 0.828 . . . . 0.0 108.906 -178.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -143.99 159.13 43.13 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -152.55 167.76 27.77 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.363 -2.458 . . . . 0.0 104.363 -176.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 60.61 57.53 2.71 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.174 0.59 . . . . 0.0 112.231 -173.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -136.08 122.46 14.02 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-O 119.442 -0.314 . . . . 0.0 111.186 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.67 164.1 1.06 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.944 3.096 . . . . 0.0 113.279 172.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.42 -17.3 64.18 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.887 0.875 . . . . 0.0 112.062 -175.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -97.93 3.98 49.55 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 47.0 t -73.07 -18.17 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 511' ' ' GLU . 1.3 m -55.38 -177.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 117.638 -1.172 . . . . 0.0 113.813 -165.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.554 ' H ' HG23 ' A' ' 510' ' ' THR . 22.9 pt-20 -18.84 -44.53 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.254 1.822 . . . . 0.0 114.834 -169.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.0 mt-10 -57.06 -48.23 79.05 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 173.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -87.64 -28.36 21.9 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 121.968 2.167 . . . . 0.0 106.323 -173.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -61.88 -35.81 79.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -75.84 -42.72 48.83 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.07 -22.3 42.42 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.477 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.6 mt -75.58 -45.01 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.126 0 CA-C-N 118.417 0.553 . . . . 0.0 110.648 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 30.7 p -68.32 -32.11 72.01 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.045 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -64.77 -39.28 93.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.834 0.349 . . . . 0.0 111.924 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.5 tp10 -71.39 -28.58 64.13 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.584 0.353 . . . . 0.0 111.272 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.75 -4.74 59.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.233 0.613 . . . . 0.0 111.691 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.6 27.85 56.31 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.829 -0.429 . . . . 0.0 112.219 175.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 6.0 p -129.73 152.58 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 C-N-CA 123.263 0.625 . . . . 0.0 112.027 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -68.64 152.93 44.69 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 121.203 0.525 . . . . 0.0 111.802 -175.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -82.24 156.23 69.14 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.81 0.844 . . . . 0.0 110.607 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.24 153.21 77.93 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.261 2.641 . . . . 0.0 111.108 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -84.78 -15.49 44.78 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.8 t -153.5 160.85 42.63 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.37 149.37 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 C-N-CA 123.311 0.645 . . . . 0.0 109.491 -176.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -147.07 143.91 28.68 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.103 0.961 . . . . 0.0 108.816 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 4.7 t -138.83 143.2 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.058 0 C-N-CA 122.877 0.471 . . . . 0.0 111.998 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -152.89 -175.23 5.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.8 p -146.12 -171.5 3.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.886 0.874 . . . . 0.0 110.28 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 102.2 -10.18 56.59 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 123.97 0.795 . . . . 0.0 111.908 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -89.87 -27.22 20.05 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 117.597 0.699 . . . . 0.0 111.648 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 83.5 p -165.83 163.86 18.72 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.447 0.699 . . . . 0.0 109.581 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -97.04 -4.21 40.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.716 0.406 . . . . 0.0 110.914 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.63 -40.6 48.77 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 89.2 p -163.21 170.6 17.5 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.14 0.495 . . . . 0.0 111.052 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.0 p -83.27 174.2 10.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.33 0.652 . . . . 0.0 110.186 177.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.9 p -153.74 162.41 41.26 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.35 -170.5 43.34 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.057 -177.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.08 160.39 22.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.484 0.713 . . . . 0.0 110.288 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -138.66 161.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.932 1.293 . . . . 0.0 108.367 177.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.75 148.73 28.9 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.28 -0.262 . . . . 0.0 111.099 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 21.3 m-90 -127.87 173.19 10.2 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.715 1.206 . . . . 0.0 112.343 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -75.19 -10.36 59.4 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.617 0.367 . . . . 0.0 110.459 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -157.93 160.73 37.9 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 121.735 -0.603 . . . . 0.0 111.118 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -74.1 -22.34 59.52 Favored 'General case' 0 CA--C 1.527 0.089 0 O-C-N 122.386 -0.196 . . . . 0.0 110.942 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 88.3 p -77.78 -27.29 50.19 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -71.51 -35.93 70.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.4 56.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.0 tp -78.23 -41.73 33.37 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.398 0.279 . . . . 0.0 111.409 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -68.59 -39.04 81.09 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.2 m -67.7 -28.42 67.66 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.4 tt -71.22 -36.88 72.02 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.19 -32.04 75.14 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 119.632 -0.538 . . . . 0.0 111.831 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.326 9.8 m-85 -100.69 -14.5 18.07 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 119.114 3.005 . . . . 0.0 119.114 177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.69 -14.53 14.79 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.972 0.806 . . . . 0.0 112.031 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -70.09 140.93 52.81 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.397 0.999 . . . . 0.0 109.073 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.47 20.29 3.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.673 1.189 . . . . 0.0 112.856 -178.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.35 135.57 52.02 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -75.98 130.93 39.18 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.121 -0.362 . . . . 0.0 111.492 -176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 61.6 mtm -100.95 152.67 20.28 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 123.145 0.578 . . . . 0.0 111.421 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -64.76 160.25 20.56 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 169.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -149.89 119.03 3.77 Favored Pre-proline 0 CA--C 1.532 0.257 0 O-C-N 122.281 -0.262 . . . . 0.0 111.184 -176.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -81.28 -16.66 9.48 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.395 2.73 . . . . 0.0 111.956 175.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -87.19 -5.15 59.08 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -175.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 177.59 167.81 36.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.2 -22.31 22.45 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.775 2.983 . . . . 0.0 111.662 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -88.77 139.05 29.33 Favored Pre-proline 0 N--CA 1.455 -0.202 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -79.58 167.67 20.6 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 123.757 2.971 . . . . 0.0 111.946 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -128.83 142.35 51.0 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 170.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.281 0.6 OUTLIER -85.99 137.95 32.34 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -175.805 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.0 134.99 37.72 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.546 ' HZ2' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -128.75 149.52 50.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 118.483 0.583 . . . . 0.0 110.574 179.788 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.53 162.49 39.93 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.864 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 21.9 p -163.73 170.82 16.45 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.398 0.679 . . . . 0.0 110.909 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -56.12 125.09 20.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.408 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 37.2 t -80.81 151.97 28.48 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.2 t -114.64 7.09 15.91 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.41 1.084 . . . . 0.0 113.767 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.83 163.95 20.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.148 0.979 . . . . 0.0 111.96 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -97.69 -2.84 40.48 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.608 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -154.55 170.27 21.87 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.518 0.727 . . . . 0.0 110.17 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.88 23.55 1.38 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.193 0.597 . . . . 0.0 110.45 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 117.627 -1.177 . . . . 0.0 110.74 -176.401 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.441 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.716 1 O4'-C1'-N19 112.464 4.264 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . 0.412 ' C6 ' ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 O4'-C1'-N19 111.819 3.619 . 0.403 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C3'-C2'-C1' 104.851 3.724 . 0.231 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.904 1 C5'-C4'-C3' 108.751 -4.499 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.956 1 O4'-C1'-N19 112.286 4.086 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.544 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.813 0 C5'-C4'-C3' 109.997 -3.668 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C5'-C4'-C3' 110.578 -3.281 . 0.049 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.005 0 C3'-C2'-C1' 104.174 2.971 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.408 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 O4'-C1'-N19 110.936 2.736 . 0.24 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.863 1 C5'-C4'-C3' 108.05 -4.967 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.272 21.8 t80 . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.83 171.44 43.59 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -70.42 176.21 7.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.303 3.336 . . . . 0.0 110.848 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -146.57 159.8 42.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.311 0.645 . . . . 0.0 110.352 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.73 157.41 38.08 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.585 0.354 . . . . 0.0 111.234 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -79.62 -3.03 45.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.111 0.564 . . . . 0.0 110.544 -177.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 47.1 t -155.97 151.13 21.1 Favored Pre-proline 0 CA--C 1.532 0.267 0 O-C-N 121.498 -0.751 . . . . 0.0 111.341 -177.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.29 -4.3 3.95 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.473 3.449 . . . . 0.0 114.03 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 6.5 m -128.47 165.77 27.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.95 0.881 . . . . 0.0 109.892 -174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.65 159.57 41.96 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.937 1.695 . . . . 0.0 107.733 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.6 ttt -143.59 138.89 29.38 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.538 0.608 . . . . 0.0 111.145 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -121.19 154.44 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -175.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.433 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 4.5 m-85 -142.44 171.09 14.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.1 13.13 72.23 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 122.141 -0.35 . . . . 0.0 112.302 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.28 28.34 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.747 0.819 . . . . 0.0 111.581 178.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -64.6 -26.33 68.36 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -76.84 149.44 36.17 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.064 0.459 . . . . 0.0 110.996 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.8 p -70.58 -6.73 38.73 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.615 0.766 . . . . 0.0 112.646 -176.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -77.95 -14.34 59.57 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.954 0.501 . . . . 0.0 112.021 -176.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 80.3 mmm -86.05 154.29 21.52 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.034 0.379 . . . . 0.0 111.23 -178.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -164.0 164.34 23.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.315 1.046 . . . . 0.0 108.509 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.0 p -64.03 -29.77 70.89 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.034 -0.416 . . . . 0.0 111.978 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.02 -26.86 36.09 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -70.96 -50.79 30.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.435 0.636 . . . . 0.0 109.606 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.15 -47.47 92.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . 0.449 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.264 1.3 m-85 -63.25 -52.35 62.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 178.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -59.42 -33.86 71.77 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 120.16 1.346 . . . . 0.0 109.458 -172.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 15.0 t -62.48 -61.88 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.561 0.8 OUTLIER -76.51 -4.98 45.57 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 176.216 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 52.9 t -75.26 -32.57 61.11 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.6 pp -62.41 -19.55 63.56 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.561 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.43 -9.31 52.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 116.919 2.192 . . . . 0.0 116.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 159.12 178.29 32.99 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 118.298 0.499 . . . . 0.0 112.234 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -68.51 140.21 55.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.449 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 18.2 m -114.01 165.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.918 1.287 . . . . 0.0 109.339 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -137.47 -60.71 0.66 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.81 154.7 37.78 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 118.738 0.699 . . . . 0.0 112.855 -175.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.9 146.72 19.73 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 C-N-CA 123.181 0.592 . . . . 0.0 109.976 176.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.2 133.07 13.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.632 0.373 . . . . 0.0 110.555 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.271 11.8 m-85 -80.38 149.6 30.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.7 mmt -75.01 131.95 40.99 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.135 0.493 . . . . 0.0 111.553 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -79.24 -25.5 42.59 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.879 0.871 . . . . 0.0 111.827 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 94.8 p -101.94 -6.78 23.06 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -113.89 152.74 45.92 Favored Pre-proline 0 CA--C 1.529 0.171 0 CA-C-N 118.507 0.594 . . . . 0.0 110.193 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.34 -15.9 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.463 2.776 . . . . 0.0 112.168 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 179.84 91.3 0.08 OUTLIER Glycine 0 C--N 1.337 0.611 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.84 159.91 35.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.639 0.775 . . . . 0.0 109.308 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.11 142.04 18.07 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.747 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.6 ptm -91.39 150.43 21.28 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.4 t -138.86 151.28 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.558 0.743 . . . . 0.0 112.13 -173.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -131.89 132.82 43.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 84.9 mtp -155.2 172.91 17.38 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.463 0.705 . . . . 0.0 109.691 -171.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -65.88 112.07 3.59 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.264 -2.125 . . . . 0.0 105.264 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -72.46 -33.41 67.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -166.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.74 -87.42 0.01 OUTLIER Glycine 0 CA--C 1.52 0.351 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -74.52 -27.3 60.48 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -88.11 -34.39 17.92 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.798 -174.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 96.6 t -85.92 -25.85 6.47 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 118.525 -1.27 . . . . 0.0 108.576 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -63.89 -52.63 59.06 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.316 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -68.91 -31.89 71.13 Favored 'General case' 0 N--CA 1.457 -0.088 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.95 -34.58 78.43 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.559 0.618 . . . . 0.0 110.219 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 41.5 mt -77.92 -13.98 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.463 0.705 . . . . 0.0 110.926 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.9 m -91.97 -22.03 20.22 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.46 -20.24 3.32 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -169.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 63.9 mt -134.48 -14.56 2.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.554 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.02 2.44 Favored 'General case' 0 C--O 1.198 -1.622 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 -169.368 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.572 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.3 m-80 76.87 22.06 1.12 Allowed 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.012 -2.93 . . . . 0.0 112.491 -161.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -85.79 162.93 18.45 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -78.72 141.94 37.48 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.8 ttt -162.03 137.85 7.61 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.262 0.625 . . . . 0.0 109.912 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.411 49.4 m-85 56.76 28.87 14.98 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.96 9.26 86.79 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -134.0 -167.67 1.99 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.036 1.334 . . . . 0.0 108.7 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -138.17 143.91 40.49 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.36 105.3 8.98 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.572 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 23.5 m-20 -64.08 132.02 49.25 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 115.709 -2.091 . . . . 0.0 111.729 -173.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.554 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.1 t -125.75 151.8 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 113.229 -3.388 . . . . 0.0 115.567 169.258 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -163.99 170.03 17.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.472 1.109 . . . . 0.0 108.568 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 5.5 t -69.85 144.31 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.9 t -87.66 153.88 21.03 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.057 0.543 . . . . 0.0 110.822 177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -101.89 1.37 36.83 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -73.87 156.21 88.26 Favored Pre-proline 0 N--CA 1.454 -0.233 0 C-N-CA 123.272 0.629 . . . . 0.0 110.036 176.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -75.87 -42.69 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.667 2.245 . . . . 0.0 111.019 176.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -171.04 164.7 7.51 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 124.196 0.998 . . . . 0.0 109.457 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.09 137.72 21.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 7.8 mmm -107.33 132.6 20.84 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 122.542 0.337 . . . . 0.0 110.691 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.1 158.61 45.39 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.228 2.619 . . . . 0.0 109.105 173.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.82 -133.1 3.59 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.368 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -72.55 158.79 35.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.599 0.76 . . . . 0.0 110.75 -176.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -151.2 169.45 21.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.433 0.693 . . . . 0.0 109.766 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -122.65 1.68 9.47 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.51 -175.14 54.95 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.35 162.39 36.57 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 124.387 1.075 . . . . 0.0 109.165 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 11.0 pm0 -70.08 -22.01 63.09 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -120.49 13.41 11.76 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -159.04 167.13 34.8 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 121.986 -0.446 . . . . 0.0 112.17 -176.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 t -86.35 -29.79 22.7 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.782 0.433 . . . . 0.0 111.777 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 87.4 m -127.06 151.52 48.5 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.008 0.523 . . . . 0.0 111.639 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 84.4 p -82.24 7.27 14.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.262 0.625 . . . . 0.0 110.728 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -134.04 147.5 50.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.312 1.445 . . . . 0.0 114.824 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -152.63 153.45 33.36 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.883 0.473 . . . . 0.0 110.315 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.256 0.1 OUTLIER -133.98 145.73 49.78 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -127.33 10.78 6.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 34.6 t -65.33 -22.59 66.84 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.259 0.624 . . . . 0.0 111.91 -174.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -114.05 2.04 14.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.045 0.538 . . . . 0.0 111.637 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -77.32 146.51 36.71 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.766 0.317 . . . . 0.0 111.372 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -79.25 -8.21 58.86 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.393 0.277 . . . . 0.0 110.87 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -63.08 -21.66 66.33 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -59.04 123.35 16.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.566 0.346 . . . . 0.0 110.125 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -80.97 -32.6 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -176.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.285 55.1 m-85 -97.96 14.26 27.94 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.4 p -74.61 -6.67 49.89 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.28 149.83 69.05 Favored Pre-proline 0 C--O 1.23 0.059 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -71.4 -24.72 22.34 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 123.235 2.623 . . . . 0.0 111.301 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -81.37 -23.97 37.35 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.066 0.394 . . . . 0.0 110.751 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -82.84 -41.81 18.59 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 173.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.21 -18.18 64.27 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.462 0.305 . . . . 0.0 111.579 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.11 -18.9 52.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.757 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -2.54 8.14 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.54 152.6 41.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.872 0.76 . . . . 0.0 110.772 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.433 ' NH1' " H2'" ' C' ' 4' ' ' ' C' . 6.4 ptp180 -150.91 138.61 19.75 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.9 mt -139.78 145.66 26.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 123.829 0.851 . . . . 0.0 108.909 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -145.3 173.48 11.93 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.6 0.76 . . . . 0.0 110.523 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -56.99 154.3 19.79 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.088 0.555 . . . . 0.0 109.558 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -63.5 148.75 92.34 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.701 2.267 . . . . 0.0 110.097 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.1 t -152.57 167.39 29.01 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.804 -174.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.66 -0.69 51.73 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 122.315 -0.241 . . . . 0.0 111.051 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 3.0 t -97.57 134.53 35.28 Favored 'Isoleucine or valine' 0 C--O 1.231 0.084 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -117.51 157.76 25.73 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.865 0.866 . . . . 0.0 109.136 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -129.37 136.97 50.67 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.166 0.986 . . . . 0.0 108.37 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -125.82 158.07 35.94 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -177.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -147.63 165.52 30.16 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 103.656 -2.72 . . . . 0.0 103.656 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.5 m120 57.95 57.42 4.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.882 0.473 . . . . 0.0 111.864 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -126.55 152.56 74.63 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.345 0.658 . . . . 0.0 110.322 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.72 162.59 40.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.728 2.286 . . . . 0.0 110.658 176.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.46 -16.56 63.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.202 0.601 . . . . 0.0 111.317 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -112.54 22.26 14.79 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.329 0.651 . . . . 0.0 111.388 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.3 p -65.93 -15.12 18.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -176.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.581 HG23 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.88 -177.23 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 117.793 -1.098 . . . . 0.0 113.863 -165.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.581 ' H ' HG23 ' A' ' 510' ' ' THR . 23.5 pt-20 -27.32 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -169.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.9 mt-10 -57.57 -47.86 80.93 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 117.545 -1.217 . . . . 0.0 114.244 170.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -86.0 -27.67 24.68 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-N 122.287 2.312 . . . . 0.0 106.346 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.52 -33.53 75.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 176.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -77.52 -41.19 40.1 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.13 -28.45 57.44 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.015 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 69.9 mt -73.32 -40.22 56.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.115 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.42 -30.17 70.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.83 -43.7 71.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -68.86 -22.08 64.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 O-C-N 122.17 -0.331 . . . . 0.0 111.837 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.88 -5.23 48.44 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.923 0.489 . . . . 0.0 111.321 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.08 4.73 60.18 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-O 119.655 -0.525 . . . . 0.0 113.782 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.02 162.44 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 CA-C-N 118.154 0.977 . . . . 0.0 112.98 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -73.34 143.86 46.74 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 174.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -71.92 149.3 92.47 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 122.823 0.449 . . . . 0.0 111.193 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.38 155.9 62.88 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.622 2.881 . . . . 0.0 110.733 177.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -86.0 -17.95 33.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.4 t -154.8 156.79 36.89 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.515 0.198 . . . . 0.0 110.995 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 96.5 t -145.06 145.6 20.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 123.879 0.872 . . . . 0.0 110.199 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -146.92 145.9 29.95 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 123.252 0.621 . . . . 0.0 109.833 175.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 7.9 t -143.7 144.55 23.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -177.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -153.78 -175.43 5.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 91.8 p -133.59 -178.99 5.25 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.543 0.737 . . . . 0.0 110.756 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 97.43 -7.22 63.69 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.862 0.744 . . . . 0.0 112.375 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -86.69 -34.84 19.6 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.715 0.757 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 39.7 t -167.18 158.39 12.0 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.963 0.505 . . . . 0.0 110.265 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -96.89 -7.97 32.03 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.2 -28.85 19.7 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.433 0.693 . . . . 0.0 111.549 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.9 p -160.56 155.91 24.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.245 0.545 . . . . 0.0 112.044 -178.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.5 t -84.22 171.98 12.29 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 66.7 m -146.75 163.64 35.32 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.631 1.172 . . . . 0.0 109.455 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.98 -173.11 46.05 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.61 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -122.39 160.39 25.55 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.597 0.759 . . . . 0.0 110.828 -177.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 70.4 mt -139.54 158.94 43.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.835 1.254 . . . . 0.0 108.48 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -150.76 147.5 27.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.936 0.335 . . . . 0.0 111.569 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -122.81 169.27 11.28 Favored 'General case' 0 C--N 1.338 0.073 0 C-N-CA 124.867 1.267 . . . . 0.0 112.633 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -76.42 -8.24 56.72 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.887 0.475 . . . . 0.0 110.861 -176.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.9 t -156.26 158.44 37.52 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 121.708 -0.62 . . . . 0.0 111.165 -178.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.01 -30.01 67.22 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.384 0.273 . . . . 0.0 111.192 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 71.8 m -79.34 -26.33 42.14 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 110.483 -0.192 . . . . 0.0 110.483 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -72.52 -30.98 64.97 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 121.042 0.449 . . . . 0.0 111.355 174.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.92 -28.04 55.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.864 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 51.6 tp -79.93 -35.2 38.11 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.439 0.296 . . . . 0.0 111.455 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -74.41 -38.35 63.1 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.725 -0.609 . . . . 0.0 109.414 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.263 0.3 OUTLIER -72.45 -21.41 61.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 175.38 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.64 -36.05 78.08 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 170.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.42 -43.96 95.99 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.253 6.6 m-85 -85.64 -18.63 32.69 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -178.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -106.56 -12.76 15.51 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.935 0.789 . . . . 0.0 112.396 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -74.98 141.05 44.03 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.239 0.927 . . . . 0.0 109.269 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 55.07 19.24 2.67 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.294 1.037 . . . . 0.0 112.636 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.253 39.9 t80 -73.24 139.2 46.05 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -72.5 125.42 27.39 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 122.309 0.243 . . . . 0.0 110.868 -176.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 75.3 mtm -83.52 152.69 24.78 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.686 0.395 . . . . 0.0 111.926 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -64.23 157.64 25.29 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -146.85 58.69 4.52 Favored Pre-proline 0 CA--C 1.533 0.29 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -177.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -69.69 1.59 4.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.88 3.053 . . . . 0.0 111.947 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -142.38 24.68 1.92 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.372 0.669 . . . . 0.0 110.626 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -150.88 154.64 25.71 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -72.6 -22.3 21.1 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.882 3.055 . . . . 0.0 111.987 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -151.81 150.46 26.22 Favored Pre-proline 0 N--CA 1.455 -0.191 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.0 160.12 43.53 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.948 3.099 . . . . 0.0 111.717 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -129.92 142.39 50.66 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 102.677 -3.083 . . . . 0.0 102.677 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.258 0.7 OUTLIER -77.37 138.37 39.27 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 179.078 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.3 tt -83.14 151.85 25.54 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.539 ' HZ1' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -137.42 150.42 47.63 Favored 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.546 178.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -157.25 165.15 36.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 111.184 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 28.8 p -158.99 170.37 22.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.45 0.7 . . . . 0.0 109.713 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -56.48 125.71 23.26 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 177.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.1 t -86.64 152.42 22.59 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -169.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -111.7 10.13 20.98 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.34 14.18 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 124.046 0.938 . . . . 0.0 111.836 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.8 mm-40 -92.01 -3.92 55.19 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.98 178.36 3.44 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.636 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.76 32.01 1.43 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.349 0.26 . . . . 0.0 111.63 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.43 -1.271 . . . . 0.0 110.701 -178.959 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.435 ' H61' ' ND2' ' A' ' 447' ' ' ASN . . . . . . . . 0 O4'--C4' 1.42 -2.73 0 O4'-C1'-N19 112.002 3.802 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C5'-C4'-C3' 110.867 -3.088 . 0.346 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.59 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.793 1 O4'-C1'-N19 112.947 4.747 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.842 0 C5'-C4'-C3' 110.844 -3.104 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.412 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 1 O4'-C1'-N19 112.865 4.665 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.52 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 C5'-C4'-C3' 109.807 -3.796 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.769 0 O4'-C1'-N19 111.404 3.204 . 0.076 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C3'-C2'-C1' 104.742 3.602 . 0.062 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.433 " H2'" ' NH1' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.422 -2.572 1 O4'-C1'-N19 112.719 4.519 . 0.049 4b . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.576 1 C5'-C4'-C3' 107.371 -5.419 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.299 42.5 t80 . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 155.81 173.44 24.45 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.75 165.96 30.38 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 124.025 3.15 . . . . 0.0 109.825 176.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . 0.417 ' HA ' ' HA2' ' A' ' 426' ' ' GLY . 41.1 p-80 -154.63 157.91 38.9 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.321 0.581 . . . . 0.0 112.182 -178.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.64 166.24 23.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.95 0.9 . . . . 0.0 111.391 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.22 -8.28 53.89 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -159.49 147.35 13.28 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 122.725 0.41 . . . . 0.0 110.985 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -13.75 36.16 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 123.565 2.843 . . . . 0.0 110.965 173.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -86.22 146.43 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -134.88 155.04 51.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.5 1.12 . . . . 0.0 108.488 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.31 134.83 34.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -174.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.07 150.46 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.097 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -139.96 176.31 8.85 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 105.254 -2.128 . . . . 0.0 105.254 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 81.74 11.84 82.31 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 116.417 -0.356 . . . . 0.0 112.426 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 62.7 mt -79.29 22.76 0.41 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.652 0.726 . . . . 0.0 112.131 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -65.17 -25.64 67.82 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -175.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -66.92 157.06 34.19 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.395 0.617 . . . . 0.0 111.599 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 81.6 p -79.05 27.39 0.24 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.75 1.22 . . . . 0.0 112.23 -172.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.87 4.23 4.15 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.294 0.638 . . . . 0.0 112.696 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 39.9 mmm -102.37 141.89 34.46 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.729 0.3 . . . . 0.0 110.201 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -154.27 152.64 30.53 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.211 0.604 . . . . 0.0 109.47 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -57.68 -37.07 72.83 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -71.3 -38.47 71.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.247 0.476 . . . . 0.0 112.184 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -76.02 -45.58 33.76 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.147 0.579 . . . . 0.0 112.233 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.61 -42.36 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -75.91 -29.93 58.59 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.764 -170.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -76.97 -30.88 56.18 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.893 1.224 . . . . 0.0 109.845 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.54 -55.75 19.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 N-CA-C 106.405 -1.702 . . . . 0.0 106.405 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.541 5.4 p90 -76.6 -4.91 45.41 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 173.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.63 -30.52 61.68 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.924 -0.485 . . . . 0.0 110.624 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.0 pp -62.34 -16.3 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.301 -0.559 . . . . 0.0 111.152 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -87.53 -7.33 57.7 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.55 -172.28 44.84 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.226 -178.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -85.03 121.04 27.23 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.082 0.553 . . . . 0.0 109.816 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.5 9.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -130.16 -59.92 1.03 Allowed 'General case' 0 C--N 1.339 0.144 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -144.14 169.77 17.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.859 1.208 . . . . 0.0 112.51 -177.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.0 p -147.24 144.13 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 125.057 1.343 . . . . 0.0 108.24 175.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -154.39 124.16 6.67 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 117.961 0.346 . . . . 0.0 111.438 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.263 5.9 m-85 -72.68 155.24 40.2 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 35.9 mmt -84.92 128.73 34.75 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.271 0.629 . . . . 0.0 111.64 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -18.29 53.29 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 84.1 p -101.95 1.59 36.91 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -126.89 152.03 74.74 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 118.342 0.519 . . . . 0.0 110.623 -175.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.0 -15.6 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.535 2.823 . . . . 0.0 111.441 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.63 94.96 0.1 OUTLIER Glycine 0 C--N 1.338 0.66 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.54 160.0 31.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.651 0.78 . . . . 0.0 109.208 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.15 144.67 14.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 77.6 mtp -84.7 154.2 22.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.712 0.805 . . . . 0.0 109.335 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 38.1 t -147.48 152.12 13.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -134.21 139.88 46.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.114 -0.366 . . . . 0.0 110.06 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.4 ptp -164.14 172.49 13.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.273 1.029 . . . . 0.0 110.047 -174.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -63.33 126.77 28.55 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.91 -34.03 66.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -169.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 375' ' ' HIS . . . -58.68 -85.79 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -178.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -64.15 -37.42 87.41 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.46 -35.96 17.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.401 -0.809 . . . . 0.0 112.876 -171.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.2 t -83.18 -28.29 7.87 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 CA-C-N 120.242 1.383 . . . . 0.0 109.153 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -68.71 -47.29 66.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.753 177.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -68.12 -36.87 80.43 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -176.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.69 77.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.944 0.793 . . . . 0.0 109.814 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 46.9 mt -76.48 -14.81 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 122.826 0.45 . . . . 0.0 110.85 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 55.4 m -97.24 -17.42 19.84 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -130.27 -26.13 2.37 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 116.29 1.959 . . . . 0.0 116.29 -169.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.61 -11.09 2.4 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 120.532 1.515 . . . . 0.0 114.27 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.549 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.96 101.18 2.62 Favored 'General case' 0 C--O 1.198 -1.615 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 -168.091 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.563 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.4 m-80 77.19 21.47 1.08 Allowed 'General case' 0 N--CA 1.483 1.221 0 O-C-N 117.381 -3.325 . . . . 0.0 112.763 -163.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.21 159.67 28.4 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.536 -0.728 . . . . 0.0 110.002 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -74.33 136.79 42.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 115.675 1.731 . . . . 0.0 115.675 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' MET . . . . . 0.417 ' HE1' ' CE2' ' A' ' 442' ' ' PHE . 19.4 ttt -157.96 140.9 14.94 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.351 0.661 . . . . 0.0 109.531 -176.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.417 ' CE2' ' HE1' ' A' ' 441' ' ' MET . 40.6 m-85 59.44 17.5 6.03 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.73 10.22 85.42 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -174.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -132.39 -162.26 1.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.509 1.523 . . . . 0.0 108.31 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -135.36 146.97 48.91 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 122.646 0.378 . . . . 0.0 110.812 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.63 99.93 5.34 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 176.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.563 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.2 m120 -65.22 131.33 46.22 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 115.746 -2.073 . . . . 0.0 112.487 -171.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.549 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.449 2.1 t -125.91 152.13 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 112.62 -3.632 . . . . 0.0 115.809 168.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.8 t -162.96 171.26 16.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.778 1.231 . . . . 0.0 108.462 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.2 p -76.18 146.95 8.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.2 t -86.33 156.86 20.05 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.066 0.547 . . . . 0.0 111.01 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -92.55 -8.51 44.17 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 111.179 0.066 . . . . 0.0 111.179 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -77.49 150.43 79.55 Favored Pre-proline 0 CA--C 1.529 0.144 0 C-N-CA 123.458 0.703 . . . . 0.0 110.637 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.58 -32.95 1.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.411 2.74 . . . . 0.0 112.484 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.03 159.89 11.57 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.364 0.666 . . . . 0.0 110.343 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 39.1 mt -91.09 122.68 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 39.1 mmm -76.11 160.48 78.12 Favored Pre-proline 0 N--CA 1.456 -0.158 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 170.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -49.11 117.56 2.92 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.752 2.301 . . . . 0.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -78.49 135.44 15.83 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 -169.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -78.32 164.13 25.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 168.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 33.4 t -143.78 159.12 43.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.961 0.8 . . . . 0.0 112.966 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -143.91 2.98 1.22 Allowed 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -177.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.4 -178.83 53.33 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 123.332 0.491 . . . . 0.0 112.009 -176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.7 mt -143.53 158.7 43.45 Favored 'General case' 0 C--N 1.334 -0.099 0 C-N-CA 123.631 0.772 . . . . 0.0 109.109 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -68.73 -14.26 62.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.21 0.204 . . . . 0.0 111.428 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -120.43 27.25 8.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.694 0.798 . . . . 0.0 111.536 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -176.58 -154.46 11.83 Favored Glycine 0 C--N 1.337 0.613 0 O-C-N 121.549 -0.719 . . . . 0.0 111.35 -178.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -132.97 -11.43 2.96 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.0 t -127.08 156.03 42.36 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.036 0.534 . . . . 0.0 110.279 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.1 p -122.7 3.74 9.52 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.598 0.759 . . . . 0.0 112.304 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -142.92 141.73 31.55 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 124.818 1.247 . . . . 0.0 114.331 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -155.13 156.68 36.21 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.963 -0.46 . . . . 0.0 111.382 -177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -119.84 132.54 55.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.695 1.198 . . . . 0.0 112.943 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -122.25 3.39 9.79 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 98.0 p -68.9 -17.57 63.99 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.568 0.347 . . . . 0.0 111.299 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -113.96 -1.58 13.77 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.306 0.642 . . . . 0.0 111.594 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.3 t -75.22 146.98 40.72 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.405 0.282 . . . . 0.0 110.941 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -76.29 -17.37 59.48 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.455 0.302 . . . . 0.0 110.792 178.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -65.74 -23.62 66.78 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.486 0.315 . . . . 0.0 110.787 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -68.49 113.55 6.13 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . 0.539 HH11 ' HG2' ' A' ' 481' ' ' ARG . 6.8 ttt-85 -81.08 -29.96 34.82 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 116.818 -0.173 . . . . 0.0 111.409 -172.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -89.01 7.46 34.68 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.1 t -71.38 -18.93 62.33 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.19 149.93 71.39 Favored Pre-proline 0 C--O 1.232 0.137 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.13 -24.52 27.91 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.026 2.484 . . . . 0.0 111.681 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -81.35 -22.68 38.24 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.164 0.438 . . . . 0.0 110.9 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.56 -39.21 17.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 122.097 -0.377 . . . . 0.0 110.019 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -69.01 -20.47 64.15 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.116 0.566 . . . . 0.0 111.443 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.42 -16.96 60.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.068 -0.395 . . . . 0.0 111.732 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -124.09 31.64 5.76 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.118 0.567 . . . . 0.0 111.773 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.89 156.84 6.2 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.311 0.577 . . . . 0.0 112.034 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.412 ' HG2' ' C6 ' ' C' ' 4' ' ' ' C' . 0.5 OUTLIER -144.23 97.58 3.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 179.711 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.5 mm -137.12 136.9 47.08 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.04 0 C-N-CA 122.845 0.458 . . . . 0.0 110.096 -174.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -152.09 173.42 14.93 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 110.21 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -57.28 156.58 14.69 Favored Pre-proline 0 CA--C 1.531 0.22 0 C-N-CA 123.454 0.702 . . . . 0.0 109.928 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.13 150.82 87.54 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 122.947 2.431 . . . . 0.0 110.007 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.0 t -155.07 166.54 33.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 -174.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -83.71 -0.91 52.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.656 0.382 . . . . 0.0 110.55 179.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -96.27 138.19 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 177.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.1 mt -123.14 155.01 37.87 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.07 0.548 . . . . 0.0 109.662 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -119.14 142.12 48.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -136.55 158.94 43.25 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 121.506 0.67 . . . . 0.0 110.2 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -150.9 168.76 23.52 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 104.181 -2.526 . . . . 0.0 104.181 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 57.54 57.51 4.29 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.864 0.465 . . . . 0.0 110.847 -174.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -135.54 110.54 10.45 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.356 0.262 . . . . 0.0 110.826 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.66 165.78 1.59 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 124.693 3.595 . . . . 0.0 113.162 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 16.4 mt -68.37 -16.46 63.93 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.006 -176.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.93 -10.6 50.07 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -81.61 -13.88 12.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -171.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.493 HG23 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.86 178.89 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -167.405 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.493 ' H ' HG23 ' A' ' 510' ' ' THR . 87.1 tt0 4.56 -64.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.541 1.936 . . . . 0.0 114.671 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.3 mt-10 -57.06 -43.0 81.62 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.9 -27.0 21.28 Favored 'General case' 0 C--N 1.35 0.6 0 CA-C-N 122.667 2.485 . . . . 0.0 105.712 -176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -60.12 -37.64 80.63 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.63 -1.228 . . . . 0.0 113.275 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.57 -49.67 52.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -79.61 -21.42 44.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.83 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 57.0 mt -71.93 -40.4 68.2 Favored 'Isoleucine or valine' 0 C--N 1.338 0.099 0 CA-C-N 119.006 0.821 . . . . 0.0 109.589 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 98.7 m -64.58 -33.99 77.2 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.688 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -63.29 -40.26 96.87 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -73.73 -9.34 58.56 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.655 0.382 . . . . 0.0 111.997 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 87.9 mt -107.86 -2.66 19.67 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.452 0.701 . . . . 0.0 111.606 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.08 -13.23 5.83 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.593 -0.56 . . . . 0.0 113.431 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 35.4 m -81.48 154.8 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.088 0 CA-C-N 118.191 0.996 . . . . 0.0 109.26 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -75.8 148.73 38.22 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.062 -0.399 . . . . 0.0 111.336 -176.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 53.3 ptt85 -70.79 156.23 92.28 Favored Pre-proline 0 CA--C 1.53 0.177 0 C-N-CA 123.277 0.631 . . . . 0.0 109.936 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.26 151.29 83.8 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.238 2.625 . . . . 0.0 110.959 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.5 t -87.11 -14.95 39.88 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 23.2 t -151.46 154.86 37.41 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 122.489 0.316 . . . . 0.0 110.639 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 57.8 t -143.62 146.38 21.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 C-N-CA 123.702 0.801 . . . . 0.0 110.187 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -147.26 141.61 26.33 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.488 0.715 . . . . 0.0 109.476 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -137.37 149.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.75 -172.44 4.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 92.0 p -140.83 -177.25 4.99 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.54 0.736 . . . . 0.0 110.628 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.6 -8.76 66.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 123.825 0.726 . . . . 0.0 112.142 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.51 -27.01 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.83 0.815 . . . . 0.0 111.017 177.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 80.2 p -165.07 165.75 19.72 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.414 0.686 . . . . 0.0 109.619 176.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.4 pm0 -96.85 -5.72 37.58 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.057 0.543 . . . . 0.0 110.915 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -77.61 -47.43 19.35 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 88.1 p -163.05 172.65 14.65 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.145 0.498 . . . . 0.0 110.929 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 42.1 t -77.41 167.3 21.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.336 0.589 . . . . 0.0 111.174 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 91.9 p -148.48 163.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.32 -165.87 36.55 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 119.772 -1.204 . . . . 0.0 113.485 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.88 159.23 25.94 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.809 0.844 . . . . 0.0 110.474 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.1 mt -137.71 155.39 49.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.953 1.301 . . . . 0.0 108.134 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -145.8 147.42 31.84 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 118.147 0.43 . . . . 0.0 111.498 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -124.67 171.08 10.35 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.929 1.292 . . . . 0.0 112.075 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -73.07 -12.22 60.83 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 47.4 t -157.52 164.48 37.32 Favored 'General case' 0 C--O 1.231 0.119 0 O-C-N 121.806 -0.559 . . . . 0.0 111.097 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -70.78 -29.2 65.33 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.477 0.311 . . . . 0.0 110.713 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 82.3 p -76.25 -26.34 55.89 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 178.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.35 -36.93 74.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.968 0.507 . . . . 0.0 111.476 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.53 -28.51 56.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.465 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 52.0 tp -74.03 -40.88 62.57 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.23 -0.294 . . . . 0.0 111.235 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.64 -36.81 73.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.622 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 2.5 m -70.31 -27.71 64.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 176.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -65.23 -39.27 92.51 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.04 -47.22 75.33 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -84.51 -27.09 27.64 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 27.6 tp -93.66 -20.0 20.59 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -69.99 149.88 47.26 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.315 0.507 . . . . 0.0 110.211 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 57.31 22.65 7.98 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.738 1.215 . . . . 0.0 113.122 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -65.44 134.75 54.14 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 177.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -76.61 121.08 22.7 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.476 0.31 . . . . 0.0 110.707 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 68.3 mtm -90.4 152.62 20.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -66.72 162.83 20.44 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.131 0.573 . . . . 0.0 109.969 172.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -150.36 119.17 3.64 Favored Pre-proline 0 CA--C 1.532 0.285 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.03 -18.92 20.94 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.402 2.735 . . . . 0.0 114.164 -173.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -156.37 -5.76 0.11 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -177.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -74.7 157.8 50.87 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 118.715 0.689 . . . . 0.0 111.578 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.45 -19.86 28.12 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.786 2.991 . . . . 0.0 111.876 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -153.6 153.94 29.7 Favored Pre-proline 0 N--CA 1.455 -0.217 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.67 164.51 35.47 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.298 2.665 . . . . 0.0 111.002 176.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -129.94 142.32 50.66 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 102.997 -2.964 . . . . 0.0 102.997 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.25 0.8 OUTLIER -84.96 140.3 31.18 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 115.321 1.601 . . . . 0.0 115.321 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.7 tt -78.26 147.14 34.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.576 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -132.28 147.97 52.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.401 -0.519 . . . . 0.0 110.619 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.26 164.01 38.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.234 0.54 . . . . 0.0 111.245 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 24.6 p -162.24 175.33 11.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.269 1.028 . . . . 0.0 110.038 -178.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -57.97 125.83 24.82 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.9 t -81.83 150.64 27.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -172.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.27 0.7 OUTLIER -114.54 10.3 16.82 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.852 1.426 . . . . 0.0 114.852 169.836 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.63 163.4 21.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.215 1.006 . . . . 0.0 111.906 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -96.95 -0.78 46.96 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.437 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -155.09 168.56 26.61 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.629 0.772 . . . . 0.0 110.293 -178.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.92 20.46 1.44 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.492 0.717 . . . . 0.0 110.381 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.457 -1.259 . . . . 0.0 110.765 -175.564 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 O4'-C1'-N19 112.059 3.859 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 0 O4'-C1'-N19 111.567 3.367 . 0.429 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.542 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.953 0 O4'-C1'-N19 111.047 2.847 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C5'-C4'-C3' 110.296 -3.469 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.414 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.893 1 O4'-C1'-N19 112.303 4.103 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.486 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 0 C3'-C2'-C1' 104.834 3.705 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C5'-C4'-C3' 110.818 -3.121 . 0.099 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.901 0 C3'-C2'-C1' 105.032 3.925 . 0.034 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.412 ' C6 ' ' HG2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.419 -2.822 0 O4'-C1'-N19 110.853 2.653 . 0.124 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 1 C5'-C4'-C3' 108.814 -4.458 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.285 17.5 t80 . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 66.67 49.66 53.97 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 119.334 -0.703 . . . . 0.0 112.584 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.35 163.15 37.54 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.618 2.878 . . . . 0.0 111.183 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -155.2 158.54 39.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.165 0.586 . . . . 0.0 110.422 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.83 160.61 31.88 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.873 0.368 . . . . 0.0 111.237 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -73.98 -6.6 48.34 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.3 t -158.85 146.93 13.7 Favored Pre-proline 0 N--CA 1.456 -0.138 0 C-N-CA 122.759 0.424 . . . . 0.0 110.49 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -12.74 34.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.492 2.795 . . . . 0.0 110.742 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.51 148.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 C-N-CA 122.846 0.458 . . . . 0.0 112.182 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.9 tt -140.28 155.71 46.74 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 14.5 tpt -139.05 131.61 28.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.241 0.473 . . . . 0.0 110.811 -174.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.26 155.12 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.8 175.11 10.43 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -176.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.24 9.62 81.7 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.071 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.81 26.79 0.4 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.467 0.707 . . . . 0.0 112.461 -177.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.6 -40.74 97.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . 0.408 ' H ' ' CD ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.43 148.61 51.62 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.122 0.487 . . . . 0.0 111.201 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 67.3 m -70.08 -8.02 46.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -72.93 -15.4 61.57 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 122.58 0.352 . . . . 0.0 111.455 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 51.6 mmm -90.72 148.0 22.88 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.924 0.392 . . . . 0.0 110.814 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -162.23 159.75 26.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.296 1.038 . . . . 0.0 108.284 175.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.9 p -59.92 -30.77 69.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -74.99 -37.04 61.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.048 0.386 . . . . 0.0 111.779 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -70.81 -51.5 26.37 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 122.726 0.41 . . . . 0.0 110.231 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 38.1 t -69.08 -43.03 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.138 0.575 . . . . 0.0 109.743 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.29 -29.48 57.41 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -73.79 -33.67 64.32 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 120.124 1.329 . . . . 0.0 109.839 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 17.6 t -57.31 -57.06 11.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.272 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.558 2.8 p90 -76.49 -4.03 40.48 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 117.758 2.503 . . . . 0.0 117.758 175.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.37 -33.15 58.91 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.881 -0.512 . . . . 0.0 111.085 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -60.81 -14.86 24.4 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -84.51 -9.78 58.03 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.17 -151.71 15.35 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.354 0.525 . . . . 0.0 112.233 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -99.57 126.15 45.5 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.551 0.34 . . . . 0.0 110.961 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.02 165.47 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.86 -62.76 1.22 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -144.28 161.17 39.6 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -169.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.14 150.32 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.45 1.1 . . . . 0.0 109.162 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -157.47 132.42 8.76 Favored 'General case' 0 CA--C 1.527 0.096 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.8 m-85 -82.89 163.66 20.98 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -122.43 123.14 40.63 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 122.838 0.455 . . . . 0.0 111.959 -177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.006 0.523 . . . . 0.0 111.254 169.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.9 p -77.91 -7.76 57.18 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.292 0.637 . . . . 0.0 112.432 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -132.13 159.47 72.04 Favored Pre-proline 0 CA--C 1.529 0.147 0 C-N-CA 124.131 0.973 . . . . 0.0 109.319 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -16.43 54.87 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.92 2.413 . . . . 0.0 111.013 177.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 173.5 101.16 0.14 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.25 158.55 39.01 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.428 0.691 . . . . 0.0 109.75 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.19 153.88 29.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.008 0.433 . . . . 0.0 110.985 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.3 ttm -107.39 151.19 25.84 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.024 0.929 . . . . 0.0 108.749 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.7 t -136.83 152.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 123.299 0.639 . . . . 0.0 111.599 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -132.12 128.93 39.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.2 mtp -152.53 171.11 18.62 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -170.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -66.92 125.65 26.61 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -73.31 -29.63 62.83 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -63.94 -83.65 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 -178.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -72.66 -36.48 67.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.72 -33.32 18.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 119.944 1.247 . . . . 0.0 114.151 -169.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 52.5 t -88.88 -24.49 6.0 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.13 1.332 . . . . 0.0 109.858 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -70.84 -50.83 31.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -65.11 -35.21 80.4 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.36 77.55 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.576 0.625 . . . . 0.0 110.552 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 72.6 mt -79.91 -9.1 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.088 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 26.0 m -98.85 -20.18 16.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.17 -29.52 2.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -169.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.06 -13.09 7.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.623 1.556 . . . . 0.0 113.56 -173.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.569 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.7 p-10 -71.62 100.79 2.36 Favored 'General case' 0 C--O 1.201 -1.46 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -167.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.547 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 11.3 m-80 76.65 22.04 1.21 Allowed 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 123.666 2.939 . . . . 0.0 113.207 -162.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -79.25 163.19 25.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.494 -0.754 . . . . 0.0 109.425 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.39 135.94 36.27 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' MET . . . . . 0.44 ' HE2' ' CE2' ' A' ' 442' ' ' PHE . 19.6 ttt -157.67 142.61 16.7 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . 0.44 ' CE2' ' HE2' ' A' ' 441' ' ' MET . 57.5 m-85 59.55 18.5 7.07 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 116.53 2.048 . . . . 0.0 116.53 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.31 11.38 85.39 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 -174.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -134.51 -162.86 1.3 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.439 1.496 . . . . 0.0 108.474 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -136.86 149.72 47.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.95 0.405 . . . . 0.0 111.023 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 13.9 ptm -127.45 83.59 2.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.116 0.966 . . . . 0.0 108.873 178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.547 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.2 m120 -55.92 127.96 32.83 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-O 115.759 -2.067 . . . . 0.0 112.21 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.569 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.43 2.0 t -128.54 152.66 36.98 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 113.48 -3.288 . . . . 0.0 116.51 169.208 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -160.3 167.44 27.49 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.375 1.47 . . . . 0.0 107.974 177.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.23 146.4 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.5 t -83.03 166.02 19.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.827 0.451 . . . . 0.0 111.253 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.16 12.48 7.12 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -85.33 151.85 57.1 Favored Pre-proline 0 N--CA 1.456 -0.151 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.05 -36.56 4.21 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.789 2.326 . . . . 0.0 112.506 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.89 158.78 7.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.764 0.425 . . . . 0.0 111.42 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -75.31 130.53 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.5 mmm -97.08 118.6 64.59 Favored Pre-proline 0 N--CA 1.454 -0.254 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.512 175.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.19 163.45 32.69 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.167 2.578 . . . . 0.0 109.772 175.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.52 -144.52 12.35 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -72.45 152.32 42.03 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.373 0.669 . . . . 0.0 109.83 -179.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 89.1 p -151.92 166.19 32.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.989 0.424 . . . . 0.0 111.439 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -84.63 -4.42 58.99 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.68 -177.69 51.35 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.7 mt -141.85 157.44 45.0 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.977 0.911 . . . . 0.0 108.996 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -75.37 -12.03 60.17 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.364 -0.21 . . . . 0.0 111.452 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -120.4 26.64 9.07 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.668 0.787 . . . . 0.0 110.122 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.92 -154.19 8.56 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -177.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 41.6 t -133.05 -26.11 1.74 Allowed 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.613 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 98.0 m -127.01 155.96 42.38 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.485 0.714 . . . . 0.0 110.338 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.4 p -75.93 -23.08 55.42 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -95.26 148.49 22.36 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -157.15 157.49 34.54 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.088 0.555 . . . . 0.0 109.901 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -134.35 153.19 52.03 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -128.01 2.67 5.9 Favored 'General case' 0 CA--C 1.527 0.091 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.3 p -66.07 -17.73 64.88 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.6 0.36 . . . . 0.0 111.762 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.05 2.07 14.83 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.405 0.682 . . . . 0.0 111.321 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 479' ' ' ASN . 39.9 t -82.33 -7.85 59.63 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.962 0.505 . . . . 0.0 112.014 -176.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 62.4 -7.96 0.12 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.126 1.37 . . . . 0.0 113.155 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . 0.504 HD22 ' CD2' ' A' ' 561' ' ' HIS . 63.9 m-20 -65.56 -15.8 63.07 Favored 'General case' 0 C--O 1.231 0.093 0 O-C-N 121.685 -0.635 . . . . 0.0 112.581 -178.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -55.56 125.34 20.61 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -72.97 -33.77 66.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -169.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.376 57.1 m-85 -98.19 8.15 45.22 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 117.946 2.573 . . . . 0.0 117.946 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.7 t -76.16 -13.78 60.18 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -132.44 149.56 73.46 Favored Pre-proline 0 C--O 1.231 0.087 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -71.58 -23.87 22.7 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.28 2.653 . . . . 0.0 111.624 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.56 -25.34 53.95 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.133 0.424 . . . . 0.0 110.317 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -86.68 -48.29 8.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -65.18 -19.53 66.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.476 0.71 . . . . 0.0 112.765 -171.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.62 -29.22 62.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.243 0.474 . . . . 0.0 111.388 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -124.06 10.25 8.77 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -60.46 154.51 20.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.663 0.665 . . . . 0.0 112.719 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . 0.417 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 12.9 ptp180 -155.34 138.71 15.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 47.2 mt -142.12 142.74 27.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 C-N-CA 123.449 0.7 . . . . 0.0 109.511 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -148.27 173.39 13.07 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 123.801 0.841 . . . . 0.0 110.336 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -58.73 153.9 39.21 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.296 0.638 . . . . 0.0 110.049 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.22 147.44 88.07 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 123.087 2.525 . . . . 0.0 110.267 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.4 t -152.67 174.49 13.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.388 0.675 . . . . 0.0 109.771 -174.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -83.68 -0.64 51.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -178.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -99.71 136.45 30.9 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.4 ' CD2' ' HB2' ' A' ' 552' ' ' ALA . 4.6 mm? -121.14 156.23 32.79 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.805 0.842 . . . . 0.0 109.644 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -127.1 142.35 51.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -136.6 158.95 43.24 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.305 0.574 . . . . 0.0 111.257 -176.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -150.16 164.49 35.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.403 -2.814 . . . . 0.0 103.403 -177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 34.0 m120 58.53 56.79 4.11 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.949 0.5 . . . . 0.0 111.104 -172.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -122.02 151.94 59.06 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.724 0.41 . . . . 0.0 111.174 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.57 154.26 37.45 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.467 2.778 . . . . 0.0 112.118 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.78 -16.55 63.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.98 0.512 . . . . 0.0 111.675 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -122.83 27.71 7.6 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 123.701 0.8 . . . . 0.0 110.968 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.8 p -63.64 -17.01 19.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.593 HG21 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.54 -177.91 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -164.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.593 ' H ' HG21 ' A' ' 510' ' ' THR . 22.7 pt-20 -21.34 -41.77 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.794 1.638 . . . . 0.0 115.215 -169.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.6 -47.2 82.81 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 172.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -86.3 -27.01 24.62 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 121.709 2.049 . . . . 0.0 106.631 -173.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -67.12 -36.26 81.52 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -76.84 -38.65 53.38 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -73.58 -28.66 61.96 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.398 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.66 -44.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 O-C-N 121.966 -0.459 . . . . 0.0 110.969 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 31.2 p -69.12 -25.44 64.4 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.183 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.96 -42.46 85.16 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -70.41 -18.3 63.02 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 70.8 mt -96.07 -6.01 39.62 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.653 0.381 . . . . 0.0 111.415 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.59 -11.87 3.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.875 0.75 . . . . 0.0 113.769 177.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 24.1 m -77.79 159.37 4.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 118.194 0.997 . . . . 0.0 110.45 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -68.9 153.68 43.36 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.113 0.482 . . . . 0.0 111.627 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -76.08 157.03 83.76 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.48 0.712 . . . . 0.0 110.692 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.26 160.09 51.2 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.343 2.696 . . . . 0.0 111.015 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -95.25 -15.75 22.98 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.1 t -154.22 159.99 41.61 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 122.793 0.437 . . . . 0.0 110.313 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.29 150.08 12.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -145.6 141.06 27.83 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 124.0 0.92 . . . . 0.0 109.071 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 25.0 t -139.9 141.46 34.12 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 C-N-CA 123.524 0.729 . . . . 0.0 110.023 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.67 167.23 29.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 -177.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 36.7 t -89.76 170.72 10.19 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.654 0.782 . . . . 0.0 110.763 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . 0.453 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 92.27 -178.07 39.9 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 123.751 0.691 . . . . 0.0 112.048 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 41.0 mttm 62.53 -12.08 0.07 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.083 1.753 . . . . 0.0 113.698 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' SER . . . . . 0.453 ' H ' ' C ' ' A' ' 534' ' ' GLY . 44.5 t -165.6 162.02 18.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.451 0.701 . . . . 0.0 110.466 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -116.95 -5.78 11.46 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.376 0.67 . . . . 0.0 110.104 174.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -91.98 -31.32 15.66 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.747 0.819 . . . . 0.0 112.275 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.7 p -159.11 168.92 25.4 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 121.089 0.471 . . . . 0.0 111.563 -171.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 32.9 t -89.5 170.93 10.09 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.847 0.859 . . . . 0.0 110.97 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.5 t -148.65 159.87 43.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.245 1.018 . . . . 0.0 109.186 178.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.71 -171.79 44.42 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.001 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 159.8 27.05 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.813 0.845 . . . . 0.0 110.441 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.0 mt -140.87 159.22 42.68 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.675 1.19 . . . . 0.0 108.859 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -150.32 148.74 29.2 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 122.102 -0.374 . . . . 0.0 111.745 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -126.72 171.36 11.25 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.106 1.362 . . . . 0.0 112.075 178.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -74.59 -10.41 59.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.59 0.356 . . . . 0.0 110.567 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.2 t -157.66 157.13 32.99 Favored 'General case' 0 C--O 1.231 0.123 0 O-C-N 121.698 -0.626 . . . . 0.0 110.444 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -75.04 -19.69 59.91 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.019 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.1 m -80.84 -29.45 35.86 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 118.188 0.449 . . . . 0.0 110.181 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.99 -36.47 72.49 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 121.41 0.624 . . . . 0.0 111.219 171.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . 0.4 ' HB2' ' CD2' ' A' ' 500' ' ' LEU . . . -72.22 -27.01 62.26 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.663 177.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.2 tp -79.82 -45.22 19.13 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.596 0.358 . . . . 0.0 111.539 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.5 -33.46 75.97 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -73.81 -28.15 61.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 175.304 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tt -70.38 -35.18 73.34 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 171.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -57.36 -49.45 72.74 Favored Glycine 0 C--N 1.335 0.519 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.305 35.1 m-85 -84.07 -11.78 56.16 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.395 2.739 . . . . 0.0 118.395 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.15 -20.68 14.07 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.823 0.738 . . . . 0.0 112.859 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -70.64 139.39 51.31 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 119.315 0.962 . . . . 0.0 109.532 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.504 ' CD2' HD22 ' A' ' 479' ' ' ASN . 2.4 t-80 55.96 17.12 2.43 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.031 1.332 . . . . 0.0 113.444 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 32.7 t80 -72.68 139.4 47.25 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -69.7 140.76 53.57 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.958 -0.464 . . . . 0.0 112.193 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.4 mtm -83.57 152.66 24.74 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.921 0.391 . . . . 0.0 111.362 175.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -74.45 161.28 29.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -149.17 122.38 4.51 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 122.2 0.2 . . . . 0.0 110.636 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.27 -24.4 7.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.567 2.845 . . . . 0.0 112.623 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -156.1 -1.17 0.13 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -70.14 153.05 51.7 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.49 -26.67 16.62 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.351 2.701 . . . . 0.0 111.309 -178.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -155.89 151.82 22.63 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 178.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.82 159.17 48.94 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.381 2.721 . . . . 0.0 111.196 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -130.01 142.32 50.64 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 102.731 -3.062 . . . . 0.0 102.731 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.263 0.6 OUTLIER -76.55 141.46 41.17 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 -176.271 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.41 138.15 32.99 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.3 1.44 . . . . 0.0 107.658 173.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.519 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -130.31 150.08 51.71 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 118.091 0.405 . . . . 0.0 110.308 -178.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.25 162.79 40.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.173 0.511 . . . . 0.0 111.247 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.6 p -158.57 167.6 29.16 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.823 0.849 . . . . 0.0 110.378 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -56.0 122.91 12.69 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.445 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 35.1 t -80.12 153.38 28.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -169.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 t -119.05 12.43 12.73 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.16 0.984 . . . . 0.0 113.434 169.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.03 20.19 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.138 0.975 . . . . 0.0 111.88 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -92.62 -3.49 54.88 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.571 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -153.9 171.49 18.9 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.75 0.82 . . . . 0.0 110.436 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.63 24.91 0.97 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.471 0.708 . . . . 0.0 110.198 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.604 -1.188 . . . . 0.0 110.439 -176.629 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 O4'-C1'-N19 112.188 3.988 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C5'-C4'-C3' 110.477 -3.349 . 0.385 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 2 C5'-C4'-C3' 105.812 -6.459 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.645 1 C5'-C4'-C3' 108.817 -4.455 . 0.01 2u . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 1 O4'-C1'-N19 113.994 5.794 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C3'-C2'-C1' 104.861 3.735 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C5'-C4'-C3' 111.22 -2.853 . 0.232 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 C3'-C2'-C1' 104.378 3.198 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.445 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 O4'-C1'-N19 111.56 3.36 . 0.243 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.73 1 C5'-C4'-C3' 108.732 -4.512 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.284 16.6 t80 . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.9 -174.82 45.43 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.34 165.29 5.83 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 124.683 3.589 . . . . 0.0 112.724 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -150.17 155.71 40.27 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.016 0.526 . . . . 0.0 110.569 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.83 161.15 29.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -76.61 -8.83 58.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.771 0.428 . . . . 0.0 110.272 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -157.29 147.77 16.03 Favored Pre-proline 0 CA--C 1.527 0.086 0 O-C-N 121.7 -0.625 . . . . 0.0 110.74 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.91 -17.21 46.57 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.239 2.626 . . . . 0.0 110.539 173.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.1 151.49 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -141.38 155.12 45.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.676 1.19 . . . . 0.0 108.338 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 43.9 tpp -136.63 137.52 40.19 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.343 0.257 . . . . 0.0 110.827 -176.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -131.69 150.91 34.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.461 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 9.9 m-85 -138.04 175.69 9.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 -178.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 12.34 77.73 Favored Glycine 0 CA--C 1.528 0.892 0 N-CA-C 112.014 -0.434 . . . . 0.0 112.014 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.22 25.95 0.57 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.343 0.657 . . . . 0.0 111.655 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -64.86 -40.21 94.79 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -176.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -67.94 147.85 51.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.0 0.429 . . . . 0.0 110.582 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 49.9 m -70.54 -8.47 51.64 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -72.95 -17.19 61.5 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.124 0.42 . . . . 0.0 111.42 178.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 66.3 mmm -85.18 148.14 26.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.088 0.403 . . . . 0.0 110.588 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.38 155.52 22.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.9 p -61.29 -30.56 70.56 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -72.45 -39.46 67.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.763 0.316 . . . . 0.0 110.559 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -76.06 -41.18 51.48 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 t -71.06 -43.65 75.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -75.1 -30.01 60.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -78.23 -28.31 47.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.018 1.281 . . . . 0.0 110.234 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.53 -57.02 13.43 Favored 'Isoleucine or valine' 0 C--N 1.341 0.222 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.551 1.6 p90 -76.65 -5.71 49.03 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.37 -32.27 68.29 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 117.973 0.351 . . . . 0.0 110.609 177.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -62.59 -14.99 48.97 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 120.321 -0.551 . . . . 0.0 111.279 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -90.5 -2.16 57.91 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 117.811 2.523 . . . . 0.0 117.811 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.0 -170.16 40.59 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.748 0.703 . . . . 0.0 113.054 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -83.07 132.62 35.11 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.54 -0.388 . . . . 0.0 110.797 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.94 165.53 8.82 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.096 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -177.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -122.49 -68.83 0.86 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.423 0.289 . . . . 0.0 111.522 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -154.54 174.44 14.93 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.219 0.463 . . . . 0.0 112.091 -177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.47 149.94 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 C-N-CA 124.426 1.09 . . . . 0.0 109.531 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -155.27 130.21 9.38 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.854 0.461 . . . . 0.0 111.314 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.279 3.7 m-85 -80.98 152.09 28.15 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 178.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 34.7 mmt -73.5 134.17 43.8 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-O 121.111 0.481 . . . . 0.0 111.808 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -79.21 -33.96 43.29 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.898 0.879 . . . . 0.0 111.974 178.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 70.7 m -102.05 -17.91 15.85 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -174.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -91.74 150.27 40.59 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 118.445 0.566 . . . . 0.0 110.562 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.18 -12.81 23.42 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.668 2.912 . . . . 0.0 112.432 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.82 81.42 0.06 OUTLIER Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.334 -0.706 . . . . 0.0 111.334 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.69 161.34 39.85 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.062 0.545 . . . . 0.0 109.87 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.95 149.28 19.54 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 78.5 mtp -93.6 151.51 19.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.973 0.909 . . . . 0.0 109.588 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.0 t -143.9 154.24 15.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -138.71 133.79 32.72 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 28.1 mtm -153.24 175.59 12.9 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 124.238 1.015 . . . . 0.0 109.5 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' ALA . . . . . . . . . . . . . . . -64.45 123.57 19.56 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 172.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -72.43 -32.41 66.3 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -167.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.83 -89.39 0.01 OUTLIER Glycine 0 C--N 1.339 0.705 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -71.68 -29.12 64.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -87.47 -35.15 18.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.765 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 55.8 t -89.3 -26.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 118.319 -1.352 . . . . 0.0 109.447 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -68.56 -49.27 60.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.064 175.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -70.41 -31.37 68.54 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.66 78.31 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.876 0.762 . . . . 0.0 110.213 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.04 -15.59 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.121 0.569 . . . . 0.0 110.882 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.7 m -91.01 -20.66 21.86 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -123.46 -29.55 3.77 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 -169.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.0 mt -134.42 -5.53 2.59 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -171.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' ASN . . . . . 0.555 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.65 100.99 2.42 Favored 'General case' 0 C--O 1.204 -1.341 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -169.225 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . 0.531 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 11.9 m-80 77.21 22.06 1.02 Allowed 'General case' 0 N--CA 1.483 1.216 0 O-C-N 117.713 -3.117 . . . . 0.0 113.019 -160.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -83.08 156.96 23.04 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.946 -1.096 . . . . 0.0 109.752 167.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.252 21.8 m-85 -74.71 142.59 44.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 28.2 ttt -161.51 140.16 9.66 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.433 0.693 . . . . 0.0 109.901 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.386 47.7 m-85 56.83 27.21 12.57 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 117.77 2.508 . . . . 0.0 117.77 -179.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.7 7.56 88.12 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -133.71 -163.49 1.37 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.953 1.301 . . . . 0.0 108.211 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -138.88 146.33 41.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.29 107.31 10.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' ASN . . . . . 0.531 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 3.6 m-20 -69.35 133.92 48.42 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 115.653 -2.118 . . . . 0.0 111.813 -171.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' VAL . . . . . 0.555 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.465 2.0 t -125.11 151.18 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 113.191 -3.404 . . . . 0.0 115.132 168.44 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.7 t -161.48 165.98 27.85 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.807 1.243 . . . . 0.0 108.269 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.1 p -70.98 148.32 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.9 t -85.52 159.79 19.82 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.963 0.505 . . . . 0.0 110.969 177.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -105.13 0.02 27.04 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 121.948 0.099 . . . . 0.0 111.144 177.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -82.16 149.68 62.9 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.46 0.704 . . . . 0.0 110.507 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.02 -34.27 2.31 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.225 2.617 . . . . 0.0 112.148 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.11 158.75 12.43 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.366 0.666 . . . . 0.0 110.452 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.7 mt -85.09 135.86 23.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 174.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 60.4 mmm -98.8 156.69 35.3 Favored Pre-proline 0 N--CA 1.454 -0.258 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.24 118.69 5.11 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.883 2.388 . . . . 0.0 110.418 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -84.77 142.8 20.3 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 -176.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -77.74 125.6 29.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.6 p -77.79 153.39 32.89 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.864 0.364 . . . . 0.0 111.194 -176.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -139.83 -5.82 1.32 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.87 118.32 0.24 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.278 0.942 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.3 mt -77.36 160.22 28.94 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -69.3 -15.42 63.34 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 122.126 -0.359 . . . . 0.0 111.671 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -120.47 24.9 10.11 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.29 0.636 . . . . 0.0 110.186 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.94 -160.31 12.24 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 121.698 -0.626 . . . . 0.0 111.698 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 71.9 m -132.97 -5.54 3.11 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 95.1 m -127.03 155.67 42.86 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.162 0.585 . . . . 0.0 110.778 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.1 m -121.23 4.34 10.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.165 0.586 . . . . 0.0 110.34 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -144.82 147.77 33.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.517 1.127 . . . . 0.0 112.619 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -154.15 154.25 33.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.189 0.449 . . . . 0.0 111.374 -177.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -128.41 139.83 52.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.216 1.006 . . . . 0.0 113.387 -177.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -126.59 5.46 6.81 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 40.9 t -64.26 -27.03 68.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.713 0.405 . . . . 0.0 111.663 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -100.85 -1.36 34.92 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 122.918 0.487 . . . . 0.0 111.601 178.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.9 t -81.56 149.57 28.59 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.125 -0.36 . . . . 0.0 111.457 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -87.5 -4.94 58.99 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.215 0.606 . . . . 0.0 111.208 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -63.34 -19.15 64.37 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -62.18 109.15 1.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.199 0.6 . . . . 0.0 109.606 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -73.99 -29.27 61.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.305 69.7 m-85 -97.98 15.14 24.95 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.3 t -74.22 -14.76 60.98 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -131.06 148.37 70.0 Favored Pre-proline 0 C--O 1.233 0.214 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -177.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -72.27 -26.25 17.77 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.278 2.652 . . . . 0.0 112.063 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -79.09 -27.93 43.02 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.495 0.589 . . . . 0.0 110.007 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -77.28 -43.97 31.39 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 175.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.48 -19.24 63.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.69 -18.1 42.13 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 -1.48 8.26 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.28 162.05 15.5 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.257 0.551 . . . . 0.0 111.673 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.16 140.98 27.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.562 0.745 . . . . 0.0 109.75 178.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 33.5 mm -143.8 138.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -149.55 173.38 13.68 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.512 0.725 . . . . 0.0 110.361 -177.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -58.74 155.06 32.7 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -64.54 151.79 84.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.839 2.359 . . . . 0.0 109.351 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -154.51 169.17 24.43 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.793 0.437 . . . . 0.0 110.042 -174.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -83.77 -8.03 59.33 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.92 145.18 8.6 Favored 'Isoleucine or valine' 0 C--N 1.339 0.112 0 C-N-CA 123.34 0.656 . . . . 0.0 111.887 173.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.0 tp -138.05 153.16 49.36 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -126.95 148.38 50.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.678 0.791 . . . . 0.0 109.103 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -144.53 160.77 40.58 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.555 0.693 . . . . 0.0 109.746 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -152.75 164.9 36.9 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 104.01 -2.589 . . . . 0.0 104.01 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 59.11 57.6 3.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.919 0.488 . . . . 0.0 111.971 -173.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.44 153.52 53.85 Favored Pre-proline 0 CA--C 1.532 0.268 0 C-N-CA 123.042 0.537 . . . . 0.0 110.454 177.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.07 159.19 54.11 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.373 2.049 . . . . 0.0 110.229 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.46 -16.53 63.93 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.603 0.361 . . . . 0.0 111.498 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -109.27 19.04 19.86 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.248 0.619 . . . . 0.0 111.449 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 3.8 p -63.26 -18.91 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.079 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -175.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.577 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.86 -177.38 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 117.852 -1.07 . . . . 0.0 113.772 -165.541 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' GLU . . . . . 0.577 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -25.92 -37.9 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -169.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.2 mt-10 -58.21 -48.08 81.48 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 117.142 -1.409 . . . . 0.0 114.451 171.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -86.63 -27.14 24.0 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 122.529 2.422 . . . . 0.0 106.686 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -65.09 -38.59 91.2 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 176.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -74.88 -37.84 62.04 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -80.43 -22.05 41.57 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.542 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 50.3 mt -76.38 -43.89 35.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.418 0.554 . . . . 0.0 110.671 177.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 29.3 p -69.28 -33.92 73.95 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.729 0.695 . . . . 0.0 110.307 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -72.46 -26.2 61.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.2 tp10 -75.27 -26.71 58.99 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.284 0.234 . . . . 0.0 110.626 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -95.96 -2.9 46.11 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.231 0.613 . . . . 0.0 111.738 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 77.06 -1.19 64.45 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 123.416 0.532 . . . . 0.0 112.832 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.92 151.6 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 CA-C-N 117.995 0.897 . . . . 0.0 111.74 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -67.15 150.18 49.49 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.017 0.437 . . . . 0.0 110.38 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -76.98 152.61 82.54 Favored Pre-proline 0 CA--C 1.531 0.221 0 C-N-CA 123.012 0.525 . . . . 0.0 110.716 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.93 156.85 61.88 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.533 2.822 . . . . 0.0 110.631 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -89.71 -18.09 27.06 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 37.8 t -154.64 160.64 41.55 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 120.494 0.188 . . . . 0.0 110.842 176.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.81 146.54 9.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -177.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -147.23 141.13 25.86 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.051 0.941 . . . . 0.0 109.068 172.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.77 151.86 28.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -155.81 177.24 11.62 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 38.0 t -141.95 165.54 27.17 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.566 0.746 . . . . 0.0 109.859 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 123.96 -19.46 7.35 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.679 0.657 . . . . 0.0 111.636 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -80.24 -23.92 40.53 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.645 0.722 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 47.6 t -164.86 157.46 16.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.764 0.826 . . . . 0.0 109.487 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -97.0 -4.71 39.29 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.431 0.292 . . . . 0.0 110.257 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -78.13 -36.53 47.75 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.9 p -161.11 167.69 25.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.436 0.636 . . . . 0.0 112.325 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 48.4 t -85.56 164.99 17.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.223 1.009 . . . . 0.0 110.738 176.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 93.6 p -150.21 162.44 40.47 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.217 1.007 . . . . 0.0 108.414 177.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.94 -169.01 42.15 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.663 -178.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -121.12 160.23 24.15 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.978 0.911 . . . . 0.0 110.423 -177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.6 mt -142.12 163.97 31.43 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.14 1.376 . . . . 0.0 109.047 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -153.69 147.28 25.1 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.331 -0.231 . . . . 0.0 111.33 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.4 m-90 -126.15 172.53 9.95 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.164 1.386 . . . . 0.0 112.33 177.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -73.5 -7.78 53.22 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 39.9 t -159.64 162.05 35.11 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 122.963 0.505 . . . . 0.0 110.674 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -69.29 -30.94 69.14 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.346 -0.221 . . . . 0.0 110.55 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.6 m -75.65 -23.36 56.3 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 122.087 0.155 . . . . 0.0 110.784 178.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -74.09 -36.36 64.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.016 0.436 . . . . 0.0 111.66 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.04 -26.39 56.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.292 176.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.9 tp -78.46 -37.55 43.22 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.367 0.267 . . . . 0.0 111.421 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -72.68 -38.25 67.64 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.16 -27.14 63.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 175.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -66.94 -41.73 86.46 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 172.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.17 -31.63 79.64 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 119.691 -0.505 . . . . 0.0 112.307 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.273 6.2 m-85 -94.52 -10.0 33.57 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 177.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 89.6 mt -119.86 -8.94 9.78 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -70.48 139.15 51.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.516 1.053 . . . . 0.0 109.289 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 58.75 17.83 5.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.997 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 29.2 t80 -68.89 138.34 54.59 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -74.0 136.6 43.19 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.782 -0.574 . . . . 0.0 112.29 -174.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.0 mtm -83.64 152.69 24.66 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.026 0.53 . . . . 0.0 111.79 175.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.3 158.32 29.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 170.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -152.15 118.42 3.11 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.8 -17.82 17.54 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.402 2.735 . . . . 0.0 114.163 -172.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -156.61 -11.72 0.1 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.21 0.913 . . . . 0.0 113.375 -176.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -70.95 157.6 53.59 Favored Glycine 0 CA--C 1.53 0.969 0 CA-C-N 118.799 0.727 . . . . 0.0 111.483 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.0 -20.65 25.2 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.91 3.074 . . . . 0.0 111.993 -177.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -154.54 153.15 27.44 Favored Pre-proline 0 N--CA 1.454 -0.234 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.39 167.23 27.82 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.589 2.859 . . . . 0.0 110.71 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -129.96 142.38 50.65 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 102.178 -3.267 . . . . 0.0 102.178 175.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.285 0.6 OUTLIER -82.42 138.48 34.41 Favored 'General case' 0 C--O 1.23 0.062 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -173.79 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -81.17 137.52 35.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.279 1.431 . . . . 0.0 107.694 172.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' LYS . . . . . 0.512 ' HZ3' ' HB2' ' A' ' 576' ' ' LYS . 0.1 OUTLIER -130.89 147.47 52.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -178.581 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.46 161.1 40.08 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.946 0.403 . . . . 0.0 111.083 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.73 173.68 12.57 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.8 0.84 . . . . 0.0 110.33 -177.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -53.98 124.5 15.69 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' SER . . . . . 0.419 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 36.6 t -77.02 153.4 34.5 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 -171.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.261 1.0 OUTLIER -123.62 9.07 8.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.719 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.96 163.87 16.29 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.494 0.718 . . . . 0.0 110.704 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -82.83 0.58 43.31 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.41 165.37 1.4 Allowed 'General case' 0 C--O 1.23 0.029 0 C-N-CA 124.536 1.134 . . . . 0.0 110.196 175.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -84.29 -6.68 59.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.394 -1.289 . . . . 0.0 111.294 -179.483 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ' A' . . . . . 0.461 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.671 0 O4'-C1'-N19 112.113 3.913 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 C5'-C4'-C3' 110.415 -3.39 . 0.353 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ' A' . . . . . 0.511 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.997 0 C3'-C2'-C1' 104.837 3.708 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.312 0 C3'-C2'-C1' 104.838 3.709 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' ' A' . . . . . 0.601 ' C8 ' H5'' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 1 O4'-C1'-N19 112.491 4.291 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 1' ' ' ' A' . . . . . 0.471 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 C3'-C2'-C1' 104.729 3.588 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.793 0 C5'-C4'-C3' 111.047 -2.968 . 0.072 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C3'-C2'-C1' 104.846 3.718 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 4' ' ' ' C' . . . . . 0.419 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.419 -2.799 0 O4'-C1'-N19 110.758 2.558 . 0.226 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.576 1 C5'-C4'-C3' 109.284 -4.144 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo . . . . . 0 N--CA 1.455 -0.77 0 N-CA-C 110.978 -0.432 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -145.4 157.94 43.93 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.917 0.487 . . . . 0.0 110.851 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.75 156.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -76.37 0.88 17.93 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -157.43 146.72 15.0 Favored Pre-proline 0 CA--C 1.53 0.18 0 C-N-CA 122.741 0.417 . . . . 0.0 110.699 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.74 -10.7 29.85 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 123.239 2.626 . . . . 0.0 111.073 173.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.98 155.77 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.617 0.767 . . . . 0.0 112.386 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -137.98 154.4 49.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.333 1.053 . . . . 0.0 109.309 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 82.3 mmm -126.01 142.41 51.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 123.399 0.68 . . . . 0.0 111.836 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -136.24 148.69 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -140.74 174.28 10.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.55 10.11 82.24 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 45.3 mt -80.45 25.96 0.39 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.531 0.732 . . . . 0.0 112.239 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.51 -39.78 94.42 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -67.58 150.62 48.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.122 0.487 . . . . 0.0 111.217 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 87.6 p -69.06 -8.75 48.04 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -77.27 -17.06 58.69 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 117.92 0.327 . . . . 0.0 111.3 -176.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 65.4 mmm -88.29 145.43 25.85 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.943 0.338 . . . . 0.0 110.422 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -160.92 158.32 27.98 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.8 p -60.28 -30.93 69.78 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -174.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -70.4 -41.54 72.85 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 177.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.96 -42.47 48.34 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.52 -174.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -69.37 -43.01 81.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -176.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.28 -30.81 57.94 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.025 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -76.97 -30.77 56.12 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.914 1.234 . . . . 0.0 110.101 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.84 -55.76 21.84 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.559 1.3 p90 -76.51 -4.72 44.19 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 117.679 2.474 . . . . 0.0 117.679 173.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.1 t -72.74 -32.36 65.62 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 122.144 -0.347 . . . . 0.0 110.414 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.39 -17.19 52.97 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.49 177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -88.5 -4.53 58.59 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.99 176.03 33.65 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-N 118.605 0.639 . . . . 0.0 112.431 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.93 134.22 49.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 122.539 -0.389 . . . . 0.0 111.698 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.02 165.47 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 124.614 1.166 . . . . 0.0 113.65 -179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -121.49 -65.36 1.14 Allowed 'General case' 0 N--CA 1.457 -0.077 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.183 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -154.47 167.02 31.44 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.1 p -138.64 150.24 23.91 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 C-N-CA 124.031 0.933 . . . . 0.0 110.136 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -151.41 125.4 9.2 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.066 0.547 . . . . 0.0 110.988 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -85.3 157.65 20.51 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.3 ptp -136.39 135.64 38.94 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 121.948 0.88 . . . . 0.0 112.487 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 413' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 413' ' ' LYS . 11.8 ptmm? -79.13 -5.7 54.77 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 126.061 1.744 . . . . 0.0 112.769 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.8 t -77.76 -4.12 44.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.918 0.326 . . . . 0.0 111.823 -171.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -141.74 157.36 65.02 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 124.159 0.983 . . . . 0.0 109.255 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.42 -11.91 33.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.177 2.585 . . . . 0.0 112.037 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.86 93.3 0.09 OUTLIER Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 175.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.5 162.78 39.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.788 0.435 . . . . 0.0 110.708 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.33 170.87 21.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.963 0.505 . . . . 0.0 110.243 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 21.6 ptm -131.97 152.23 51.24 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.695 0.798 . . . . 0.0 109.181 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.4 t -138.55 150.49 24.05 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.208 0 C-N-CA 123.184 0.594 . . . . 0.0 112.236 -173.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -129.06 131.09 47.27 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 46.0 mtp -152.87 174.89 13.52 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.588 0.755 . . . . 0.0 109.439 -170.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.468 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.66 115.5 7.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.5 p30 -72.24 -32.6 66.85 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -167.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.94 -86.47 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -74.65 -27.08 60.27 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 117.125 2.268 . . . . 0.0 117.125 -176.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.84 -35.2 17.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.074 -174.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.8 t -86.41 -27.21 6.07 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 CA-C-N 119.776 1.171 . . . . 0.0 108.818 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -66.19 -50.79 62.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.036 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -70.35 -30.56 67.55 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.54 -33.92 76.75 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.65 0.659 . . . . 0.0 110.168 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 52.5 mt -80.1 -16.84 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.472 0.709 . . . . 0.0 110.782 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -90.22 -19.71 23.85 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -126.14 -28.53 3.13 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 91.2 mt -134.38 -8.35 2.56 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.54 1.518 . . . . 0.0 114.911 -170.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.6 p-10 -71.67 101.06 2.45 Favored 'General case' 0 C--O 1.202 -1.418 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.4 m-80 79.4 20.75 0.66 Allowed 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 124.281 3.219 . . . . 0.0 114.058 -161.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -75.71 162.99 27.75 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.065 -1.022 . . . . 0.0 110.641 167.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -80.0 140.16 36.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 175.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.1 ttt -160.41 138.4 9.84 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.831 0.852 . . . . 0.0 109.957 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 52.6 m-85 56.99 24.21 9.22 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.59 9.46 86.4 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.661 -0.575 . . . . 0.0 111.661 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -135.18 -168.91 2.27 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.905 1.282 . . . . 0.0 108.716 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -122.0 151.85 40.37 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.653 0.263 . . . . 0.0 111.221 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 10.5 ptm -127.25 75.74 1.61 Allowed 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 124.873 1.269 . . . . 0.0 109.203 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -53.35 128.1 27.19 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 115.482 -2.199 . . . . 0.0 112.266 -173.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.428 2.0 t -126.64 150.87 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.439 -3.304 . . . . 0.0 115.76 168.624 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -164.74 170.27 15.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.645 1.178 . . . . 0.0 109.71 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.0 t -74.53 145.54 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 45.4 t -86.15 170.04 12.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.55 0.74 . . . . 0.0 111.414 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -115.98 0.72 13.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.554 0.342 . . . . 0.0 110.479 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -76.24 150.15 82.61 Favored Pre-proline 0 CA--C 1.53 0.183 0 C-N-CA 123.685 0.794 . . . . 0.0 110.94 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.91 -38.48 1.22 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.953 2.435 . . . . 0.0 111.522 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.93 159.54 7.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.719 0.808 . . . . 0.0 110.213 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 50.8 mt -78.36 143.94 11.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.077 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 82.1 mtp -120.22 130.37 24.88 Favored Pre-proline 0 CA--C 1.528 0.112 0 CA-C-N 117.622 0.192 . . . . 0.0 111.498 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.34 170.09 20.07 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 124.033 3.155 . . . . 0.0 109.612 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.17 -123.91 1.78 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -72.42 157.89 36.79 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.035 0.534 . . . . 0.0 109.738 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 91.9 p -151.93 174.08 14.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.834 0.454 . . . . 0.0 110.273 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.97 3.25 4.05 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.82 -175.05 54.65 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -176.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 78.7 mt -143.94 166.46 24.9 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.332 1.053 . . . . 0.0 109.328 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.81 -30.42 68.98 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 122.304 -0.248 . . . . 0.0 110.821 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -120.46 13.7 11.84 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -147.41 163.12 28.73 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 -178.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.8 t -86.57 -32.34 20.71 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.66 0.384 . . . . 0.0 111.703 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.5 m -127.1 155.63 43.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.3 0.64 . . . . 0.0 111.296 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.9 p -79.17 3.31 18.09 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.7 0.4 . . . . 0.0 110.778 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -136.04 149.71 48.89 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -152.99 151.83 30.72 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.39 0.276 . . . . 0.0 110.597 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -121.58 137.83 54.57 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -130.89 4.34 4.5 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 94.7 p -66.76 -16.09 64.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.104 0.562 . . . . 0.0 111.997 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -114.08 1.29 14.57 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.117 0.567 . . . . 0.0 111.322 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.5 t -77.96 149.0 34.2 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.785 0.434 . . . . 0.0 111.483 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 478' ' ' ARG . 12.6 ttp180 -81.69 -8.02 59.66 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.737 0.415 . . . . 0.0 110.87 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -62.38 -21.58 65.46 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 122.386 0.274 . . . . 0.0 111.695 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -61.91 112.77 2.45 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -30.05 59.94 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.286 66.6 m-85 -97.98 11.94 35.84 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -74.53 -13.83 60.73 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -134.58 149.27 70.45 Favored Pre-proline 0 C--N 1.338 0.102 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.78 -24.73 21.08 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 123.211 2.607 . . . . 0.0 111.797 -177.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -76.84 -16.78 59.33 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.232 0.469 . . . . 0.0 110.584 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 63.1 mm-40 -92.53 -45.71 7.98 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 173.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.13 -18.69 61.6 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.798 0.439 . . . . 0.0 112.177 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.12 -22.79 44.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -124.09 -0.66 8.34 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -61.4 156.8 18.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.377 0.535 . . . . 0.0 111.143 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -150.85 139.75 20.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.4 mm -140.61 138.18 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.725 0.81 . . . . 0.0 109.293 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -150.21 173.37 14.01 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.625 0.77 . . . . 0.0 110.052 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -60.51 152.86 63.91 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 122.926 0.49 . . . . 0.0 109.908 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.61 159.34 51.38 Favored 'Trans proline' 0 N--CA 1.449 -1.124 0 C-N-CA 123.209 2.606 . . . . 0.0 110.352 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 93.9 p -156.59 177.52 11.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -83.75 -2.67 56.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.03 143.41 11.26 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 123.756 0.822 . . . . 0.0 112.376 175.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.32 149.61 47.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -120.41 151.39 39.36 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.517 0.727 . . . . 0.0 109.199 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -144.0 159.32 42.8 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.41 0.624 . . . . 0.0 112.018 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -149.17 167.76 25.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 102.99 -2.967 . . . . 0.0 102.99 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 56.68 57.49 4.74 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 122.226 -0.296 . . . . 0.0 111.182 -174.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -128.91 152.07 78.5 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.859 0.464 . . . . 0.0 110.597 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.78 154.51 31.48 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.515 2.81 . . . . 0.0 113.132 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.4 -16.48 63.93 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.494 0.718 . . . . 0.0 111.66 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -122.95 24.75 8.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.441 0.696 . . . . 0.0 110.835 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.03 -9.56 10.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -175.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.73 -177.32 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -165.306 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -28.64 -35.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.8 mt-10 -58.87 -46.3 88.14 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 116.915 -1.517 . . . . 0.0 114.553 170.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -87.66 -27.6 22.36 Favored 'General case' 0 C--N 1.354 0.792 0 CA-C-N 122.826 2.557 . . . . 0.0 106.861 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -66.65 -32.45 73.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.65 -46.26 39.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -76.44 -24.4 53.92 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.626 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.6 mt -74.91 -44.38 45.04 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 118.588 0.631 . . . . 0.0 110.203 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 86.4 m -66.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.53 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -69.54 -24.02 63.66 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -77.47 -30.89 53.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.266 0.227 . . . . 0.0 110.668 175.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 94.0 mt -86.17 -3.66 59.01 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.028 0.531 . . . . 0.0 111.141 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.04 -3.11 62.59 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 123.35 0.5 . . . . 0.0 112.377 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.8 t -77.36 148.47 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 CA-C-N 117.696 0.748 . . . . 0.0 111.825 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.94 133.97 51.99 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -75.37 152.67 85.82 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.727 0.411 . . . . 0.0 110.03 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -65.06 153.18 79.53 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.335 2.69 . . . . 0.0 111.579 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -83.88 -14.75 50.35 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 33.5 t -152.36 153.8 34.35 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 122.478 0.311 . . . . 0.0 110.321 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 60.9 t -145.81 145.94 19.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.44 0.696 . . . . 0.0 110.958 -175.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -146.45 145.23 30.15 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.645 0.778 . . . . 0.0 109.461 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 10.7 t -143.52 144.21 23.62 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.72 -173.08 4.44 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.9 p -139.05 -179.24 5.73 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.95 0.9 . . . . 0.0 110.157 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.37 -9.62 67.14 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 123.74 0.686 . . . . 0.0 112.232 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -88.51 -26.26 22.13 Favored 'General case' 0 C--N 1.338 0.109 0 CA-C-N 117.816 0.808 . . . . 0.0 110.281 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.4 t -165.62 152.66 10.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.908 0.883 . . . . 0.0 109.441 177.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -97.12 -6.02 35.96 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.526 0.33 . . . . 0.0 110.49 175.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.83 -26.64 16.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.177 0.591 . . . . 0.0 111.509 -176.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 25.9 t -159.66 161.8 35.03 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.143 0.429 . . . . 0.0 111.261 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 22.9 t -88.4 170.94 10.5 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.833 0.853 . . . . 0.0 111.932 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.4 t -152.49 160.01 43.28 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.636 1.175 . . . . 0.0 109.204 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.38 -173.49 46.22 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.351 -0.452 . . . . 0.0 112.643 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.51 160.22 26.06 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.584 0.754 . . . . 0.0 110.728 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.2 mt -139.12 162.65 34.43 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 125.265 1.426 . . . . 0.0 108.907 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -152.55 146.85 25.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 122.284 -0.26 . . . . 0.0 111.144 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.5 m-90 -122.72 171.81 8.89 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.788 1.235 . . . . 0.0 112.526 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -77.48 -7.77 56.72 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.915 0.486 . . . . 0.0 111.134 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 38.6 t -155.47 159.58 39.9 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.639 -0.663 . . . . 0.0 111.402 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.52 -34.19 73.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.818 0.447 . . . . 0.0 110.521 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 73.5 m -75.55 -23.83 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.093 0.157 . . . . 0.0 110.785 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -71.79 -35.93 70.15 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.69 -28.75 60.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.525 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.42 -38.77 55.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.697 0.399 . . . . 0.0 111.561 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -72.31 -36.2 68.84 Favored 'General case' 0 C--O 1.233 0.187 0 O-C-N 121.697 -0.627 . . . . 0.0 109.51 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.27 -20.48 63.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.9 -40.18 79.29 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 173.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.32 -39.35 95.86 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 119.792 -0.449 . . . . 0.0 111.984 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 558' ' ' PHE . . . . . 0.429 ' C ' HD22 ' A' ' 559' ' ' LEU 0.26 6.6 m-85 -88.52 -16.41 32.73 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.279 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 559' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 558' ' ' PHE . 4.2 mm? -115.01 -9.07 12.43 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -72.4 147.55 46.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.783 1.174 . . . . 0.0 109.588 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t60 57.24 17.53 3.67 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 37.0 t80 -70.1 138.75 52.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 178.082 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.98 133.74 41.63 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.076 -0.39 . . . . 0.0 111.875 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.6 mtm -83.68 152.43 24.75 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.626 0.371 . . . . 0.0 111.156 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 172.223 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.5 p90 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -72.0 161.54 44.52 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.488 2.792 . . . . 0.0 111.297 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.89 142.38 50.67 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 102.545 -3.132 . . . . 0.0 102.545 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.256 0.7 OUTLIER -80.28 139.76 36.51 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.9 tt -84.47 152.17 24.14 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.414 1.085 . . . . 0.0 108.873 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.17 149.28 47.15 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 122.154 -0.341 . . . . 0.0 110.344 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.8 pp -153.95 162.63 41.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.106 0.479 . . . . 0.0 111.255 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 15.1 p -166.64 172.1 10.97 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.825 0.85 . . . . 0.0 110.75 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -56.14 127.23 29.63 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 33.2 t -81.97 148.89 28.45 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.259 1.0 OUTLIER -110.99 10.44 22.18 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 169.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.59 167.44 18.52 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.115 0.966 . . . . 0.0 111.491 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -93.99 -3.22 51.86 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -171.37 177.98 3.38 Favored 'General case' 0 C--N 1.338 0.101 0 C-N-CA 123.555 0.742 . . . . 0.0 110.16 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -134.92 21.33 3.51 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.812 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 178.137 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 N--CA 1.454 -0.803 0 N-CA-C 111.005 -0.421 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -154.85 158.9 40.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.94 165.11 23.85 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.074 0.55 . . . . 0.0 111.346 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -75.48 -7.28 53.72 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.9 t -157.65 147.95 15.81 Favored Pre-proline 0 CA--C 1.531 0.219 0 O-C-N 122.149 -0.345 . . . . 0.0 111.196 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.39 -13.81 22.22 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 124.028 3.152 . . . . 0.0 111.909 172.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.4 t -100.38 151.47 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.558 0.743 . . . . 0.0 112.785 -177.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -130.7 153.75 48.66 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.396 1.478 . . . . 0.0 108.32 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -137.9 128.59 26.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.108 0.413 . . . . 0.0 111.018 -175.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.86 153.57 27.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -142.56 173.5 11.48 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.33 9.72 78.93 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.22 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.2 mt -77.29 28.27 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.463 0.705 . . . . 0.0 111.849 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.65 -27.65 68.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -173.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.481 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -77.83 149.96 34.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 121.288 0.566 . . . . 0.0 111.16 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 48.2 t -68.46 -14.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.309 0.643 . . . . 0.0 112.635 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.3 -17.32 63.72 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 46.5 mmm -85.75 148.2 25.97 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 118.53 0.604 . . . . 0.0 110.866 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.79 158.71 28.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.378 0.671 . . . . 0.0 109.259 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 99.5 m -54.3 -40.6 68.06 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 122.322 0.249 . . . . 0.0 110.809 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.69 -38.69 77.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -75.95 -46.0 32.08 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.26 -40.64 80.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.403 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 2.4 t80 -76.15 -31.25 58.47 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -170.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 398' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.3 p30 -76.97 -28.44 55.14 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.714 1.143 . . . . 0.0 110.227 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.1 t -58.24 -57.79 9.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.566 1.7 p90 -76.56 -4.92 45.39 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 118.175 2.658 . . . . 0.0 118.175 173.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 42.7 t -73.85 -35.01 64.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.764 -0.585 . . . . 0.0 111.24 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.92 -12.41 11.1 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -87.92 -8.99 54.99 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 117.21 2.3 . . . . 0.0 117.21 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 176.87 -148.71 9.12 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.434 0.561 . . . . 0.0 112.733 -176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -107.12 130.43 54.69 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.102 0.561 . . . . 0.0 110.49 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.403 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.1 m -114.11 165.57 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -177.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -129.06 -53.71 1.2 Allowed 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -152.11 165.38 34.94 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.195 0.907 . . . . 0.0 113.045 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.87 147.04 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 124.6 1.16 . . . . 0.0 109.085 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -152.26 116.23 4.89 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.125 0.57 . . . . 0.0 111.376 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.86 158.08 29.6 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 115.821 1.786 . . . . 0.0 115.821 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -114.8 120.95 41.77 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.842 0.457 . . . . 0.0 112.123 -176.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -79.31 -13.06 59.89 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.9 0.48 . . . . 0.0 111.475 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 96.0 p -82.34 1.44 37.06 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.251 0.62 . . . . 0.0 111.895 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -139.81 157.15 70.3 Favored Pre-proline 0 C--N 1.34 0.153 0 C-N-CA 124.311 1.044 . . . . 0.0 109.306 -177.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -68.08 -16.91 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.97 2.446 . . . . 0.0 111.343 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.79 100.65 0.14 Allowed Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.58 158.86 34.72 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.531 0.733 . . . . 0.0 109.633 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -159.64 148.29 17.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.109 0.481 . . . . 0.0 112.078 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.4 mtp -94.34 154.53 17.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.14 0.976 . . . . 0.0 108.99 170.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -145.38 151.43 15.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -134.33 135.64 42.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 8.0 ptp -166.04 174.61 9.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.611 0.764 . . . . 0.0 110.138 -173.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.84 120.47 11.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -72.39 -33.39 67.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -168.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.76 -86.61 0.02 OUTLIER Glycine 0 C--N 1.335 0.495 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -71.59 -30.89 66.34 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.37 -36.4 20.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 119.259 -0.976 . . . . 0.0 112.403 -174.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -84.45 -28.3 6.95 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 C-N-CA 118.808 -1.157 . . . . 0.0 110.049 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.86 -46.7 67.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.79 175.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -39.03 89.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.246 -0.284 . . . . 0.0 110.941 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.43 91.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.795 -0.566 . . . . 0.0 110.29 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 59.9 mt -78.47 -8.77 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.283 0.633 . . . . 0.0 111.209 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 54.4 m -102.22 -18.22 15.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -127.48 -29.56 2.67 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -169.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 89.4 mt -134.67 -11.08 2.38 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.467 1.485 . . . . 0.0 114.368 -172.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.71 101.0 2.45 Favored 'General case' 0 C--O 1.205 -1.272 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -168.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.626 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 14.8 m-80 76.88 21.72 1.15 Allowed 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 123.333 2.788 . . . . 0.0 113.741 -161.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -87.07 162.23 17.7 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.258 58.0 m-85 -76.96 138.68 39.81 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -158.74 137.46 11.09 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.448 0.699 . . . . 0.0 109.484 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.1 m-85 57.23 25.34 10.93 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 117.266 2.321 . . . . 0.0 117.266 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.3 9.59 86.88 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 -177.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -135.81 -164.16 1.5 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.057 1.343 . . . . 0.0 108.52 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -129.06 146.65 50.97 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.108 -0.37 . . . . 0.0 111.281 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptm -118.96 75.14 1.01 Allowed 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.947 0.899 . . . . 0.0 109.442 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.626 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.4 m120 -53.0 125.23 16.53 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 116.272 -1.823 . . . . 0.0 112.192 -173.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.424 2.0 t -128.74 150.6 34.55 Favored 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 113.455 -3.298 . . . . 0.0 116.434 169.446 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.1 t -159.61 172.25 18.14 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.212 1.405 . . . . 0.0 107.807 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.5 p -72.3 147.28 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 18.9 t -82.51 156.65 23.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -96.6 -12.4 24.01 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.001 0.121 . . . . 0.0 110.954 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -83.75 153.45 64.33 Favored Pre-proline 0 N--CA 1.454 -0.252 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.03 -34.52 2.18 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.335 2.69 . . . . 0.0 112.306 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.52 159.04 11.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.177 0.444 . . . . 0.0 111.695 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 87.7 mt -83.72 150.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 173.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 62.0 mtm -125.5 130.24 24.16 Favored Pre-proline 0 CA--C 1.53 0.178 0 O-C-N 122.312 -0.243 . . . . 0.0 111.213 173.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.7 165.36 26.95 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.933 3.089 . . . . 0.0 110.87 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 147.62 -108.73 0.44 Allowed Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 177.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -72.51 162.43 29.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 120.837 0.351 . . . . 0.0 110.278 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.9 p -161.27 177.04 10.57 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.914 0.486 . . . . 0.0 110.321 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -144.46 163.44 33.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.96 162.62 54.39 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 121.11 0.283 . . . . 0.0 113.077 -174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.88 171.27 10.86 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.017 0.927 . . . . 0.0 109.94 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -69.33 -26.89 64.93 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.293 -0.254 . . . . 0.0 111.061 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -120.17 11.7 11.67 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.34 -171.6 28.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.801 -0.52 . . . . 0.0 111.801 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 70.2 m -124.91 -7.91 7.23 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -177.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.2 t -127.07 138.95 53.3 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 85.3 p -85.31 9.1 16.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.874 0.87 . . . . 0.0 111.627 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -138.24 151.61 47.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.09 146.51 25.58 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.691 0.396 . . . . 0.0 110.1 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -112.25 139.98 47.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -126.0 4.59 7.24 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 45.7 t -65.81 -20.64 66.32 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.915 0.486 . . . . 0.0 111.499 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -113.86 1.48 14.78 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.51 . . . . 0.0 111.423 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 42.3 t -77.67 147.28 35.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.894 0.378 . . . . 0.0 111.334 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.21 -8.32 48.86 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.816 0.447 . . . . 0.0 110.926 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -61.88 -20.03 63.29 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 122.76 0.424 . . . . 0.0 112.052 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -58.74 115.36 3.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.235 0.614 . . . . 0.0 109.627 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -74.78 -33.43 62.26 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -172.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -95.25 16.04 17.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.3 p -70.99 -10.9 60.55 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.4 149.94 67.08 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.94 -25.32 59.7 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.989 2.459 . . . . 0.0 111.614 176.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -75.49 -28.31 59.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.363 0.265 . . . . 0.0 110.698 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -81.97 -46.11 14.45 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.96 -16.97 61.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -78.19 -19.77 53.23 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.443 0.297 . . . . 0.0 111.785 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.04 -2.93 8.13 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -65.12 159.64 22.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.498 0.59 . . . . 0.0 110.317 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -151.79 145.94 25.35 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.3 mm -140.53 139.83 34.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.747 0.819 . . . . 0.0 109.356 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -150.11 166.38 29.96 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.179 0.991 . . . . 0.0 109.661 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.51 138.84 97.48 Favored Pre-proline 0 C--O 1.233 0.203 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.36 151.07 81.91 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.463 2.775 . . . . 0.0 111.339 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 83.1 p -148.42 -173.73 4.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.303 -175.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -83.74 4.72 27.61 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.813 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.15 137.97 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 73.3 mt -124.5 155.58 38.72 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.989 0.515 . . . . 0.0 109.782 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -121.75 144.44 48.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.352 1.061 . . . . 0.0 108.265 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -136.65 159.25 42.38 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.457 0.646 . . . . 0.0 110.688 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -152.27 168.45 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 103.722 -2.695 . . . . 0.0 103.722 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 57.61 57.49 4.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.678 0.391 . . . . 0.0 111.486 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -142.23 119.46 7.25 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 122.392 -0.193 . . . . 0.0 111.176 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.04 161.75 3.18 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 124.417 3.411 . . . . 0.0 113.219 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.52 -16.41 63.87 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.275 0.63 . . . . 0.0 111.914 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -94.07 -1.99 53.54 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.5 m -78.93 -11.5 13.15 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.9 m -55.25 179.07 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.226 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -168.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.655 ' H ' HG22 ' A' ' 510' ' ' THR . 89.0 tt0 12.09 -68.8 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.851 2.061 . . . . 0.0 114.189 175.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 510' ' ' THR . 95.8 mt-10 -54.36 -48.14 71.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -88.0 -23.57 23.77 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 121.941 2.155 . . . . 0.0 106.014 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -62.13 -40.8 97.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 118.259 -1.376 . . . . 0.0 113.468 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -72.61 -44.07 62.46 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -77.38 -18.9 56.93 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.491 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.5 mt -75.51 -39.16 40.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.116 0 CA-C-N 118.486 0.585 . . . . 0.0 109.509 173.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.8 -38.69 89.64 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.769 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -68.7 -29.36 67.78 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -75.08 -26.52 59.39 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.392 0.277 . . . . 0.0 110.775 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.72 -2.16 44.99 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 111.326 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.86 -0.7 61.22 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 123.295 0.474 . . . . 0.0 113.104 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.0 151.16 5.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.893 0.847 . . . . 0.0 112.206 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.42 149.84 49.72 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.937 0.398 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.94 152.92 91.02 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 123.112 0.565 . . . . 0.0 111.226 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.57 157.59 60.21 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.631 2.887 . . . . 0.0 110.529 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -89.22 -17.14 29.66 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.7 t -155.21 159.13 39.87 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.613 0.244 . . . . 0.0 111.421 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 62.6 t -143.13 144.93 23.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 C-N-CA 124.449 1.1 . . . . 0.0 110.09 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -148.18 140.97 24.66 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.18 143.74 29.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -154.89 -171.77 3.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.8 t -141.44 -172.15 3.46 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.765 0.826 . . . . 0.0 109.91 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 100.46 11.22 42.19 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 123.526 0.584 . . . . 0.0 112.373 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -126.95 -17.32 4.91 Favored 'General case' 0 C--N 1.339 0.148 0 CA-C-N 117.762 0.781 . . . . 0.0 112.593 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -163.56 152.96 14.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 117.876 0.307 . . . . 0.0 110.774 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.93 -8.09 31.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.921 0.489 . . . . 0.0 110.63 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -79.38 -41.85 26.86 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.254 0.622 . . . . 0.0 111.684 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.5 p -164.05 173.59 12.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 110.814 -173.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 45.5 p -83.44 177.74 8.33 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.547 0.689 . . . . 0.0 111.066 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.6 p -150.57 163.06 39.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.75 -169.67 42.65 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.827 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.33 160.28 23.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.448 0.699 . . . . 0.0 110.479 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.9 mt -139.27 157.96 44.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.858 1.263 . . . . 0.0 108.091 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -148.12 149.23 31.65 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.093 0.406 . . . . 0.0 111.995 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -127.12 175.06 8.41 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.351 1.461 . . . . 0.0 112.39 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -76.52 -12.3 60.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.609 0.364 . . . . 0.0 110.999 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.5 t -158.32 160.52 37.08 Favored 'General case' 0 C--O 1.232 0.163 0 O-C-N 121.808 -0.557 . . . . 0.0 110.851 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -75.15 -21.54 58.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.02 -0.425 . . . . 0.0 110.935 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.4 m -77.25 -25.67 51.73 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.019 0.372 . . . . 0.0 110.065 174.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -74.72 -34.05 62.51 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.245 0.618 . . . . 0.0 111.896 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.35 -28.96 57.03 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.386 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.5 tp -72.74 -39.25 67.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.734 0.243 . . . . 0.0 111.284 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -73.39 -39.03 65.41 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -26.27 62.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 176.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 556' ' ' LEU . . . . . 0.421 ' C ' HD13 ' A' ' 556' ' ' LEU . 1.6 tm? -68.11 -37.73 81.49 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 172.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.94 -30.05 75.51 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.559 -0.578 . . . . 0.0 112.325 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 7.5 m-85 -98.69 -8.25 26.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 118.924 2.935 . . . . 0.0 118.924 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.36 -8.69 10.51 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -72.05 145.36 48.31 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.354 0.979 . . . . 0.0 108.923 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.64 21.84 9.2 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.571 0.748 . . . . 0.0 112.326 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -61.54 134.24 56.62 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -81.11 121.21 25.82 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.047 -0.408 . . . . 0.0 110.732 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.8 152.61 18.33 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? . . . . . 0 C--O 1.233 0.2 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 169.364 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 6.6 p90 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.51 168.85 14.28 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.689 2.926 . . . . 0.0 111.486 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -129.82 142.37 50.69 Favored 'General case' 0 N--CA 1.457 -0.109 0 N-CA-C 103.049 -2.945 . . . . 0.0 103.049 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.251 1.0 OUTLIER -81.67 131.3 35.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -178.053 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -78.5 149.29 33.17 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.03 147.25 46.09 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.566 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.92 159.84 38.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.647 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 20.4 p -160.81 174.74 13.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.024 0.929 . . . . 0.0 110.144 -177.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -58.09 124.45 19.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.3 t -79.76 149.52 31.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -171.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.266 0.8 OUTLIER -111.38 9.97 21.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 169.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.82 164.42 19.66 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.231 1.012 . . . . 0.0 111.863 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -92.83 -3.07 55.3 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.709 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -170.6 177.0 4.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.746 0.818 . . . . 0.0 110.074 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.41 28.33 1.2 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.072 0.549 . . . . 0.0 111.64 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 117.426 -1.273 . . . . 0.0 111.154 -177.797 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.456 -0.687 0 CA-C-O 120.974 0.323 . . . . 0.0 112.821 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -148.59 152.3 36.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.915 0.486 . . . . 0.0 110.728 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.72 26.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.066 0.547 . . . . 0.0 110.882 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -82.81 -0.93 50.23 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.1 t -156.96 144.77 14.08 Favored Pre-proline 0 C--O 1.232 0.151 0 C-N-CA 122.804 0.442 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.7 -15.29 33.56 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.209 2.606 . . . . 0.0 110.836 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.01 150.91 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.1 153.03 42.49 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.933 0.893 . . . . 0.0 109.707 -175.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' MET . . . . . 0.432 ' O ' HG13 ' A' ' 448' ' ' VAL . 97.0 mmm -120.32 147.59 44.82 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 123.55 0.74 . . . . 0.0 111.39 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 5.9 p -139.65 146.2 25.67 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -143.21 173.71 11.35 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.56 61.75 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.673 -0.571 . . . . 0.0 111.673 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 20.7 mt -75.73 32.32 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.881 0.872 . . . . 0.0 111.481 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -71.08 14.29 0.16 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -174.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -137.12 149.57 47.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.126 0.571 . . . . 0.0 110.811 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 39.3 t -69.53 -13.63 62.43 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.495 0.718 . . . . 0.0 112.057 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -67.77 -20.61 65.24 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 122.676 0.39 . . . . 0.0 111.875 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 67.4 mtp -94.28 148.57 22.08 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.069 -0.394 . . . . 0.0 110.615 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.78 154.39 28.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.3 p -59.17 -30.69 68.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -176.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -70.09 -43.23 71.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -76.03 -42.1 48.84 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 41.4 t -69.32 -42.31 81.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -76.29 -29.99 57.59 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.805 -0.616 . . . . 0.0 111.19 -171.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -75.95 -31.04 58.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.344 0.975 . . . . 0.0 109.857 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.97 -55.63 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.55 1.8 p90 -76.59 -4.86 45.12 Favored 'General case' 0 C--N 1.339 0.147 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.8 t -72.39 -34.31 67.82 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 122.008 -0.432 . . . . 0.0 110.867 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.52 -14.46 19.88 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.096 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.33 -3.48 58.46 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.6 -174.83 43.29 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 119.193 0.906 . . . . 0.0 113.262 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -76.34 130.12 37.62 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -129.93 -61.3 1.0 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 176.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -148.39 165.13 32.02 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -170.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.37 145.01 21.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 124.774 1.23 . . . . 0.0 108.485 171.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -153.7 121.49 5.98 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -76.98 166.93 22.66 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.8 ptp -142.82 138.0 30.04 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 118.879 0.763 . . . . 0.0 112.714 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -5.56 53.98 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.706 1.202 . . . . 0.0 112.156 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.0 t -78.06 -4.97 49.9 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.214 0.605 . . . . 0.0 111.646 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.49 155.57 67.15 Favored Pre-proline 0 CA--C 1.53 0.184 0 C-N-CA 123.993 0.917 . . . . 0.0 109.918 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 -13.75 38.14 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.392 2.728 . . . . 0.0 111.894 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.43 87.27 0.07 OUTLIER Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -152.48 160.44 43.25 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.963 0.505 . . . . 0.0 110.838 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.61 170.43 22.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.663 0.385 . . . . 0.0 110.434 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 22.1 mtm -123.97 157.34 34.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.034 0.934 . . . . 0.0 108.828 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -142.0 152.03 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.756 0.822 . . . . 0.0 110.38 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.73 132.87 42.78 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtp -155.13 172.39 18.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -171.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.08 127.05 30.6 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 170.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -73.07 -34.76 66.43 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -168.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.11 -89.1 0.01 OUTLIER Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -72.78 -26.54 61.57 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.7 -36.43 17.4 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 118.838 -1.145 . . . . 0.0 111.668 -174.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.79 -27.31 6.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.205 0 C-N-CA 118.553 -1.259 . . . . 0.0 109.374 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -68.77 -53.39 22.05 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.108 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 25.6 mtm180 -68.9 -29.99 68.39 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.05 78.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.094 -0.643 . . . . 0.0 110.011 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.72 -9.97 12.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.303 0.641 . . . . 0.0 111.084 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 29.9 m -96.77 -21.33 17.61 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -125.79 -26.9 3.41 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -169.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 88.1 mt -134.59 -8.75 2.48 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.906 1.684 . . . . 0.0 114.624 -172.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.637 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.2 p-10 -71.63 101.09 2.43 Favored 'General case' 0 C--O 1.207 -1.157 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -168.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.573 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 16.3 m-80 77.47 22.02 0.97 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 123.98 3.082 . . . . 0.0 114.054 -160.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -76.87 163.06 27.12 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.906 -1.121 . . . . 0.0 110.207 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -68.71 136.61 53.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 173.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.9 ttt -158.43 142.26 15.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 442' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 554' ' ' GLU 0.273 53.2 m-85 59.92 15.63 5.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.514 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.16 9.17 70.74 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -136.03 -171.14 2.8 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.497 1.119 . . . . 0.0 108.439 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -128.43 136.2 50.54 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.088 -0.383 . . . . 0.0 110.795 178.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -94.82 -152.51 0.36 Allowed 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 31.4 t-20 -159.22 129.28 5.69 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 115.903 -1.999 . . . . 0.0 110.521 175.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.637 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.459 2.1 t -124.03 145.25 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 112.864 -3.534 . . . . 0.0 115.147 167.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -161.29 164.76 29.99 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.869 0.868 . . . . 0.0 109.442 -176.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.4 p -75.29 150.69 6.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 37.0 t -93.29 158.09 15.92 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.726 0.81 . . . . 0.0 111.997 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -96.85 -7.88 32.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.667 0.387 . . . . 0.0 110.552 175.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -71.01 147.52 93.9 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.494 0.717 . . . . 0.0 110.526 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.9 -32.91 2.39 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.195 2.597 . . . . 0.0 111.435 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.77 158.87 9.34 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.544 0.738 . . . . 0.0 110.395 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 67.5 mt -82.89 133.42 29.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 34.2 mmm -98.0 129.32 31.3 Favored Pre-proline 0 N--CA 1.454 -0.274 0 C-N-CA 122.374 0.27 . . . . 0.0 111.241 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.32 161.95 37.04 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.437 2.758 . . . . 0.0 109.024 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 151.76 -129.52 2.85 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 121.128 -0.558 . . . . 0.0 111.899 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -72.32 171.3 12.43 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.267 0.627 . . . . 0.0 111.149 -177.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.6 p -156.01 170.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.538 0.735 . . . . 0.0 109.403 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -128.75 5.88 5.55 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.39 -170.95 55.16 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.215 -0.303 . . . . 0.0 112.499 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.3 mt -143.01 168.35 19.91 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.081 0.952 . . . . 0.0 109.592 -178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -75.22 -24.34 57.71 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 122.364 -0.21 . . . . 0.0 110.45 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -120.61 20.27 11.8 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.618 0.767 . . . . 0.0 110.825 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.33 167.32 36.86 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.604 -0.685 . . . . 0.0 112.289 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 t -93.66 -26.67 16.95 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.73 0.412 . . . . 0.0 112.111 -176.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.7 t -127.02 148.03 50.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.986 0.515 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.4 p -90.17 7.94 35.48 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.394 0.678 . . . . 0.0 111.418 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -134.34 145.82 49.37 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -156.57 151.73 26.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.888 0.375 . . . . 0.0 110.663 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.1 130.32 41.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.587 0.755 . . . . 0.0 112.25 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.54 -12.03 41.12 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 117.542 2.423 . . . . 0.0 117.542 -173.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 43.9 t -68.93 -29.93 68.27 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.641 0.257 . . . . 0.0 110.357 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -80.0 -18.38 50.4 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.699 0.399 . . . . 0.0 111.117 177.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.2 m -93.87 -4.0 50.78 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.873 0.469 . . . . 0.0 112.056 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 478' ' ' ARG . 0.1 OUTLIER 61.66 3.96 0.96 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.311 1.044 . . . . 0.0 112.83 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -59.61 -17.64 34.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -57.05 122.27 11.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.247 0.619 . . . . 0.0 110.625 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -81.05 -33.66 33.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.304 64.7 m-85 -98.0 10.46 40.29 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 117.376 2.362 . . . . 0.0 117.376 -178.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 86.5 p -71.79 -10.72 60.19 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -135.96 148.98 67.19 Favored Pre-proline 0 C--O 1.232 0.136 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 179.623 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.47 -24.63 63.64 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 123.237 2.625 . . . . 0.0 111.554 176.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -73.97 -27.5 61.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.344 0.257 . . . . 0.0 110.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -88.44 -43.17 11.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 175.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.39 63.79 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.48 -18.61 44.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -124.06 -4.9 7.94 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -62.93 158.97 17.85 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.105 0.411 . . . . 0.0 110.752 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -150.03 144.91 26.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.5 mm -136.29 153.03 30.69 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 C-N-CA 123.891 0.876 . . . . 0.0 108.724 -175.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -155.01 162.26 41.13 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -57.28 153.01 28.54 Favored Pre-proline 0 CA--C 1.531 0.225 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -63.81 143.41 86.06 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.923 2.416 . . . . 0.0 109.644 -177.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.4 t -153.63 171.93 18.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.774 0.43 . . . . 0.0 110.205 -173.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -83.73 2.31 38.48 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.265 -0.272 . . . . 0.0 110.877 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.39 137.81 24.82 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 71.0 mt -125.39 156.09 39.34 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.081 0.553 . . . . 0.0 109.691 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -125.09 132.79 53.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -120.96 160.59 23.21 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 111.505 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -147.79 153.6 39.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 28.0 m120 55.52 57.47 5.32 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.072 -175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -113.6 153.06 45.9 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 122.897 0.479 . . . . 0.0 110.205 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -57.7 153.63 41.84 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.493 2.795 . . . . 0.0 112.696 -177.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.65 -16.3 63.79 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.381 0.672 . . . . 0.0 112.059 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -122.95 25.0 8.77 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.484 0.714 . . . . 0.0 110.95 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.61 -9.35 10.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 512' ' ' GLU . 0.2 OUTLIER -54.88 -177.29 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 117.214 -1.374 . . . . 0.0 114.222 -165.016 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.506 ' H ' HG22 ' A' ' 510' ' ' THR . 8.8 pm0 -30.86 -33.55 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.397 1.453 . . . . 0.0 114.77 -167.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.0 mt-10 -60.3 -45.64 92.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 117.047 -1.454 . . . . 0.0 114.723 170.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -87.53 -30.03 20.89 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 122.745 2.52 . . . . 0.0 106.528 -173.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -62.44 -33.81 75.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -76.15 -42.71 45.8 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -79.84 -19.27 48.77 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.659 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.2 -44.87 42.75 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 118.698 0.681 . . . . 0.0 110.081 175.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.6 m -64.19 -33.93 76.91 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.902 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -67.28 -37.39 83.35 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.013 0.435 . . . . 0.0 112.01 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -74.46 -30.71 61.98 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.707 0.403 . . . . 0.0 111.124 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.35 -4.61 58.99 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.649 0.379 . . . . 0.0 111.926 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 71.95 33.6 62.58 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.62 159.63 42.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.57 0.748 . . . . 0.0 112.889 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.08 149.09 50.83 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.138 0.575 . . . . 0.0 111.736 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -91.13 157.13 43.33 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.572 0.749 . . . . 0.0 111.023 -178.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -68.23 160.83 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.575 2.85 . . . . 0.0 111.196 174.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -97.87 -18.6 18.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 38.1 m -148.49 156.34 42.33 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.671 . . . . 0.0 110.959 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 59.7 t -143.98 148.22 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.543 0.737 . . . . 0.0 110.863 -175.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -147.35 142.36 27.02 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 123.804 0.842 . . . . 0.0 108.884 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -140.51 142.82 30.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 122.99 0.516 . . . . 0.0 112.282 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -156.09 -175.61 5.52 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -178.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.2 p -142.71 -169.09 2.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.465 1.106 . . . . 0.0 109.336 178.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.43 8.85 62.25 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.698 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.02 9.62 2.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 117.699 0.749 . . . . 0.0 111.371 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 42.5 t -158.63 157.62 32.24 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.765 0.826 . . . . 0.0 109.543 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -116.96 -5.34 11.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.996 0.518 . . . . 0.0 111.037 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -89.91 -50.17 6.19 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 122.843 0.457 . . . . 0.0 112.205 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 80.6 p -165.53 179.0 6.35 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 122.77 0.428 . . . . 0.0 110.94 -177.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 74.3 m -70.22 168.95 14.69 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.8 t -147.07 163.96 34.58 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.58 1.552 . . . . 0.0 108.398 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.12 -171.92 44.92 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.126 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.82 160.31 22.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.8 0.84 . . . . 0.0 110.484 -177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.3 mt -140.66 158.16 44.38 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.647 1.179 . . . . 0.0 108.936 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -148.72 152.21 36.23 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 117.607 0.185 . . . . 0.0 111.228 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.4 m-90 -128.42 167.84 16.45 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.869 1.268 . . . . 0.0 112.785 -177.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -70.53 -8.32 50.42 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -158.44 161.22 37.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.51 0.324 . . . . 0.0 110.932 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -66.13 -34.83 78.94 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.906 0.482 . . . . 0.0 110.219 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.9 p -78.35 -25.82 46.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.425 0.29 . . . . 0.0 110.893 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -68.79 -35.34 76.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.39 65.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 48.0 tp -65.51 -40.06 92.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.613 0.244 . . . . 0.0 110.585 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 554' ' ' GLU . . . . . 0.484 ' HG3' ' CE1' ' A' ' 442' ' ' PHE . 39.8 tt0 -64.27 -47.93 77.67 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.479 0.657 . . . . 0.0 110.712 177.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.86 -19.2 61.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.62 -44.29 82.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 173.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.9 -45.69 96.03 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.284 19.0 m-85 -76.86 -32.02 57.22 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 119.103 3.001 . . . . 0.0 119.103 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 57.8 mt -90.73 -19.29 23.71 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 119.504 1.047 . . . . 0.0 112.933 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -73.99 145.34 44.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.131 0.878 . . . . 0.0 110.118 -178.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 57.54 12.62 1.58 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.431 1.093 . . . . 0.0 113.091 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 40.1 t80 -72.9 138.83 46.45 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -71.73 132.83 45.08 Favored 'General case' 0 N--CA 1.457 -0.114 0 O-C-N 122.212 -0.305 . . . . 0.0 111.706 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.1 mtm -83.73 152.56 24.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.59 0.356 . . . . 0.0 110.96 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.471 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.1 p90 . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 116.232 1.938 . . . . 0.0 116.232 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.77 164.46 33.56 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.806 3.004 . . . . 0.0 111.746 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -129.98 142.35 50.64 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 103.047 -2.945 . . . . 0.0 103.047 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -76.65 142.21 40.7 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.864 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.1 tt -83.88 150.32 25.79 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.196 0.998 . . . . 0.0 108.457 173.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -134.0 151.38 51.42 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 118.475 0.58 . . . . 0.0 111.147 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.4 pp -159.46 167.69 28.07 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.104 0.478 . . . . 0.0 111.43 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 12.5 p -162.6 174.05 13.13 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.293 1.037 . . . . 0.0 110.409 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -57.36 121.38 10.05 Favored 'General case' 0 C--N 1.34 0.156 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.9 t -77.83 149.15 34.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -170.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 0.6 OUTLIER -110.98 9.93 22.19 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 114.7 1.371 . . . . 0.0 114.7 169.545 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.22 166.57 16.06 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.161 0.984 . . . . 0.0 111.84 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -93.32 -3.03 54.21 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.84 177.97 3.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.575 0.75 . . . . 0.0 110.04 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -144.62 31.8 1.18 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.762 0.425 . . . . 0.0 111.607 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.89 -178.864 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo . . . . . 0 N--CA 1.452 -0.915 0 N-CA-C 110.719 -0.531 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -147.89 154.59 40.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 120.868 0.366 . . . . 0.0 110.815 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.43 161.14 30.1 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.151 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -75.44 -5.71 46.42 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.2 t -158.71 146.7 13.68 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 122.895 0.478 . . . . 0.0 110.553 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.21 -16.79 40.12 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.288 2.659 . . . . 0.0 110.519 174.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.57 148.77 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.7 tt -137.6 152.0 48.93 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.771 1.229 . . . . 0.0 107.966 -178.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.1 tpt -134.59 130.11 35.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.397 0.142 . . . . 0.0 110.779 -172.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.68 152.85 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -139.91 172.16 13.17 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 104.624 -2.361 . . . . 0.0 104.624 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.84 9.42 77.8 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 120.141 -0.255 . . . . 0.0 112.653 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.8 mt -79.02 27.89 0.23 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.553 0.676 . . . . 0.0 112.244 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.81 -41.46 95.77 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -67.04 146.22 54.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.051 0.453 . . . . 0.0 111.016 -178.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 56.6 m -68.68 -10.12 54.34 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -173.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -73.17 -19.62 61.08 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 117.939 0.336 . . . . 0.0 111.612 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 86.8 mmm -82.32 146.65 29.29 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.157 0.435 . . . . 0.0 110.587 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -160.92 155.74 23.89 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -59.13 -36.79 75.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -176.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -68.23 -39.33 82.37 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -75.93 -47.51 24.9 Favored 'General case' 0 C--N 1.34 0.153 0 O-C-N 122.192 -0.318 . . . . 0.0 111.651 -173.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.38 -37.74 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.8 -31.84 57.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -75.94 -29.9 58.51 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.703 1.138 . . . . 0.0 110.296 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -60.13 -55.8 21.74 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 2.5 p90 -76.57 -3.93 40.18 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 117.505 2.409 . . . . 0.0 117.505 174.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 40.6 t -74.95 -35.0 62.14 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.059 -0.401 . . . . 0.0 110.803 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.09 -15.83 26.66 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.13 -7.39 59.64 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 117.295 2.331 . . . . 0.0 117.295 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.64 -143.21 6.99 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 -176.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -113.77 132.94 55.66 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.801 0.44 . . . . 0.0 110.773 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.5 8.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -117.63 -67.42 0.99 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -154.45 170.51 21.21 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.73 148.48 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.066 0 C-N-CA 123.845 0.858 . . . . 0.0 109.42 -177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -152.31 108.52 3.4 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 122.576 0.351 . . . . 0.0 111.415 -174.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -73.24 163.88 27.48 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 24.0 ptp -142.18 142.03 32.66 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -5.57 54.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.742 1.617 . . . . 0.0 112.987 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.6 t -77.87 -8.18 57.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.109 0.563 . . . . 0.0 112.238 -172.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -141.03 157.52 66.89 Favored Pre-proline 0 CA--C 1.528 0.12 0 C-N-CA 123.644 0.777 . . . . 0.0 109.598 -177.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -67.54 -12.23 34.92 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.181 2.588 . . . . 0.0 111.496 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.05 95.4 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.56 160.41 38.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.208 0.603 . . . . 0.0 110.05 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.03 153.95 23.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.22 0.533 . . . . 0.0 111.732 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 83.3 mtp -96.97 153.29 17.99 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.948 0.899 . . . . 0.0 108.985 172.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.8 t -145.51 153.83 13.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -139.07 134.29 32.75 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 30.3 mtp -151.86 173.31 14.94 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 123.757 0.823 . . . . 0.0 109.388 -170.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.31 125.07 23.92 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 169.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.93 -33.1 65.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -167.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.17 -89.33 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -73.74 -23.69 59.79 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.97 -32.56 15.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 118.737 -1.185 . . . . 0.0 112.107 -175.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.2 -25.06 6.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 120.179 1.354 . . . . 0.0 109.082 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -68.53 -50.15 54.2 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 118.056 0.389 . . . . 0.0 111.302 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.64 -37.0 85.32 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.35 80.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.732 0.697 . . . . 0.0 110.674 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.2 mt -77.72 -12.76 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 123.028 0.531 . . . . 0.0 110.81 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.8 m -96.8 -18.96 19.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.449 ' C ' HD22 ' A' ' 436' ' ' LEU . 92.9 m-70 -129.5 -25.76 2.6 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 116.161 1.912 . . . . 0.0 116.161 -169.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.9 mm? -129.52 -14.32 4.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.144 1.338 . . . . 0.0 113.473 -172.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.662 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 32.8 p-10 -71.94 100.91 2.55 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -168.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.1 m-80 76.69 21.27 1.28 Allowed 'General case' 0 N--CA 1.481 1.088 0 O-C-N 117.916 -2.99 . . . . 0.0 112.264 -162.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -84.03 157.45 21.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -77.51 139.37 39.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.6 ttt -159.12 138.61 11.55 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.022 0.529 . . . . 0.0 109.597 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.399 49.8 m-85 56.92 25.79 10.95 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 -178.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 77.95 10.33 86.3 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 111.501 -0.639 . . . . 0.0 111.501 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -134.83 -167.3 1.96 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.861 1.264 . . . . 0.0 108.913 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -132.29 147.81 52.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.285 0.234 . . . . 0.0 111.031 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 18.7 ptt? -125.36 87.23 2.67 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 176.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.0 m120 -55.45 128.35 33.92 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 115.634 -2.127 . . . . 0.0 111.907 -174.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.662 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.423 2.4 t -126.82 154.15 36.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.28 -3.368 . . . . 0.0 116.059 169.052 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 37.9 t -162.09 167.42 24.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.568 1.547 . . . . 0.0 107.757 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.93 147.91 10.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 26.2 t -79.44 165.18 23.33 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 122.52 0.328 . . . . 0.0 110.5 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.4 31.56 6.27 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' GLN . . . . . 0.412 ' HB2' ' HD2' ' A' ' 454' ' ' PRO . 12.0 pt20 -137.12 160.91 64.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 454' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' A' ' 453' ' ' GLN . 83.3 Cg_endo -75.0 -37.1 2.18 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.986 2.457 . . . . 0.0 116.198 -167.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -166.01 154.5 11.06 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.946 1.248 . . . . 0.0 112.889 -176.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 66.0 mt -77.05 150.83 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 173.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 54.9 mtm -129.27 136.79 29.7 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 117.584 0.175 . . . . 0.0 111.319 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.78 168.75 23.65 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.085 3.19 . . . . 0.0 110.564 177.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 143.37 -115.04 0.88 Allowed Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -72.43 153.55 41.35 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.1 0.56 . . . . 0.0 110.454 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 46.9 m -152.96 172.56 16.62 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.135 0.974 . . . . 0.0 110.03 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -144.58 164.07 32.01 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -83.38 132.08 10.83 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.22 163.37 26.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 174.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.69 -18.52 64.95 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -120.55 23.11 10.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.102 0.561 . . . . 0.0 109.931 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.97 -162.31 15.75 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.691 -0.631 . . . . 0.0 112.351 -176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 98.2 p -133.1 -10.74 2.95 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 122.727 0.411 . . . . 0.0 112.001 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.1 t -127.09 155.9 42.55 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.912 0.485 . . . . 0.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 80.2 p -115.72 8.96 15.07 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.446 0.698 . . . . 0.0 111.794 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -135.5 146.29 47.96 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -155.37 157.65 37.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.468 0.175 . . . . 0.0 110.64 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -128.77 139.35 52.24 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -173.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -133.78 5.07 3.63 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 31.9 t -65.39 -22.69 66.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.266 0.627 . . . . 0.0 111.825 -174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -113.89 1.48 14.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.156 0.582 . . . . 0.0 111.479 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -79.66 153.33 29.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.526 0.33 . . . . 0.0 111.365 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -85.42 -7.51 58.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.509 0.324 . . . . 0.0 111.283 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.13 -20.74 59.81 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -60.5 127.61 32.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -70.11 -33.76 72.25 Favored 'General case' 0 N--CA 1.458 -0.066 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -170.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.363 55.8 m-85 -98.14 17.53 18.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.5 t -60.0 -28.57 67.83 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -172.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.56 155.32 75.37 Favored Pre-proline 0 C--N 1.339 0.129 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -178.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.27 -25.37 76.64 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.306 2.671 . . . . 0.0 112.066 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -74.65 -29.75 61.37 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -80.43 -45.42 17.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.78 66.12 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.6 -25.0 56.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.936 0.335 . . . . 0.0 111.609 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -124.02 3.84 8.67 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -61.19 154.7 22.64 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.425 0.557 . . . . 0.0 111.679 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -154.63 141.87 19.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.0 mm -137.22 148.66 26.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.648 0.779 . . . . 0.0 109.337 -174.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -148.52 170.03 18.96 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.512 0.725 . . . . 0.0 110.59 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -64.43 157.09 74.13 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.71 148.32 90.16 Favored 'Trans proline' 0 N--CA 1.448 -1.197 0 C-N-CA 122.524 2.15 . . . . 0.0 109.808 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.9 t -153.95 173.66 15.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.815 0.446 . . . . 0.0 109.839 -173.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -83.74 -3.18 57.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.279 -0.263 . . . . 0.0 110.732 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -96.95 138.22 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 176.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 65.6 mt -125.5 156.52 38.85 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.19 0.596 . . . . 0.0 109.862 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -124.53 143.42 50.68 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -132.96 160.13 37.98 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.977 0.418 . . . . 0.0 111.452 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -144.16 150.96 38.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 51.83 57.42 6.54 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.304 1.042 . . . . 0.0 112.587 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -104.14 156.33 35.89 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.512 0.725 . . . . 0.0 110.302 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.83 153.04 32.65 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.317 2.678 . . . . 0.0 112.742 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.67 -16.34 63.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.442 0.697 . . . . 0.0 112.047 -176.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -122.92 20.99 9.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.523 0.729 . . . . 0.0 110.949 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.74 -16.12 19.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.47 -177.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -165.849 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.677 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -22.72 -41.04 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -170.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.2 mt-10 -58.49 -47.53 83.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 117.268 -1.349 . . . . 0.0 114.358 172.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -87.0 -28.32 22.71 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 122.416 2.371 . . . . 0.0 106.776 -172.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -65.35 -37.57 87.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 119.22 -0.992 . . . . 0.0 113.599 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -75.98 -37.66 58.28 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -81.71 -22.16 37.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.491 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.1 mt -75.94 -41.46 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 CA-C-N 118.624 0.647 . . . . 0.0 110.065 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.0 m -67.88 -34.77 77.31 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.089 0.404 . . . . 0.0 111.092 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.51 -34.74 72.65 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -69.19 -25.13 64.18 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.494 0.317 . . . . 0.0 110.922 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.81 -5.18 35.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.332 0.653 . . . . 0.0 111.552 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.2 -3.86 43.96 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.473 0.559 . . . . 0.0 113.02 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.8 m -78.79 164.56 3.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 CA-C-N 117.777 0.789 . . . . 0.0 112.522 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -67.37 149.1 50.75 Favored 'General case' 0 C--N 1.338 0.088 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -84.17 149.06 54.78 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.889 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.33 150.0 70.28 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.127 2.551 . . . . 0.0 110.589 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -85.24 -18.18 34.77 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 35.7 m -150.51 155.44 39.49 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.41 0.684 . . . . 0.0 110.982 176.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 91.7 t -144.01 147.92 19.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 123.644 0.777 . . . . 0.0 110.072 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -149.71 141.75 23.91 Favored 'General case' 0 N--CA 1.457 -0.081 0 C-N-CA 123.311 0.644 . . . . 0.0 109.369 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.71 142.74 31.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 123.227 0.611 . . . . 0.0 112.089 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -155.94 -173.8 4.68 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 99.0 p -138.53 -171.08 2.97 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.276 1.031 . . . . 0.0 110.115 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.52 7.77 57.79 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 119.779 -0.456 . . . . 0.0 112.326 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -125.56 -14.03 6.41 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 117.594 0.697 . . . . 0.0 112.154 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 34.8 t -162.23 148.31 13.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.861 0.464 . . . . 0.0 110.502 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -97.76 -8.07 29.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.916 0.486 . . . . 0.0 110.614 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -85.03 -38.64 18.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.245 0.618 . . . . 0.0 112.116 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 3.6 m -161.82 165.41 27.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.938 0.495 . . . . 0.0 111.816 -172.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 66.2 m -80.04 170.21 16.78 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.612 0.765 . . . . 0.0 111.697 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.2 m -142.97 165.06 28.38 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 124.392 1.077 . . . . 0.0 108.688 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.0 -170.08 43.23 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.046 -178.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.84 158.81 29.47 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.908 0.883 . . . . 0.0 110.349 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.3 mt -139.96 158.71 43.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 108.665 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.6 148.63 28.87 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.171 -0.331 . . . . 0.0 111.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -123.77 170.91 10.06 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 124.818 1.247 . . . . 0.0 112.644 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.81 -10.64 59.7 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.739 0.415 . . . . 0.0 111.037 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -156.48 160.39 39.51 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.678 -0.639 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -69.81 -30.67 68.25 Favored 'General case' 0 C--N 1.337 0.055 0 C-N-CA 122.412 0.285 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.4 p -75.36 -27.38 59.12 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -74.16 -32.49 63.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.597 0.359 . . . . 0.0 111.22 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.21 -36.95 58.35 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 175.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 37.3 tp -70.57 -37.4 73.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.321 -0.237 . . . . 0.0 111.446 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -70.69 -39.82 73.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.251 0.8 OUTLIER -68.99 -20.25 64.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 175.261 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.05 -42.55 89.37 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.18 -30.13 75.27 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.684 -0.509 . . . . 0.0 111.949 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.337 9.6 m-85 -96.74 -2.97 43.27 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 66.0 mt -127.25 -9.13 5.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -73.87 147.01 43.65 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.689 1.132 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t60 57.58 22.12 7.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.807 0.843 . . . . 0.0 112.204 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.34 134.78 56.95 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -77.16 119.29 20.64 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 122.285 -0.26 . . . . 0.0 110.729 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 74.6 mtm -83.57 152.69 24.73 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.148 0.499 . . . . 0.0 112.107 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt . . . . . 0 N--CA 1.455 -0.21 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.123 170.925 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 114.598 1.332 . . . . 0.0 114.598 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.15 162.97 40.3 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.953 2.435 . . . . 0.0 110.849 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -129.91 142.31 50.67 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 103.348 -2.834 . . . . 0.0 103.348 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.6 OUTLIER -85.08 139.06 32.02 Favored 'General case' 0 CA--C 1.528 0.135 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -176.52 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 4.6 tt -85.22 145.79 27.4 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.47 151.92 51.84 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.044 -0.663 . . . . 0.0 111.036 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.62 165.14 37.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.583 0.552 . . . . 0.0 111.678 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 23.0 p -163.78 175.81 10.13 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.192 0.997 . . . . 0.0 110.257 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -58.89 125.49 23.77 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.6 t -82.17 152.07 26.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -171.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.3 t -118.26 12.71 13.53 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 169.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.05 161.3 24.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.826 0.85 . . . . 0.0 111.907 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -92.08 -3.2 56.05 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.414 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -152.84 169.98 21.46 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 123.84 0.856 . . . . 0.0 110.477 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.49 25.86 0.96 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.644 0.778 . . . . 0.0 110.148 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.502 -175.947 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 121.047 0.353 . . . . 0.0 112.969 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -150.0 155.99 40.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.276 0.63 . . . . 0.0 110.019 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.53 160.34 27.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.709 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.13 -0.92 33.68 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 378' ' ' SER . . . . . 0.412 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 36.1 t -155.19 148.58 18.49 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.921 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 379' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 44.2 Cg_exo -60.79 -4.07 3.26 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 124.539 3.493 . . . . 0.0 113.945 176.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 p -139.67 157.22 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.106 0 CA-C-O 121.514 0.673 . . . . 0.0 109.319 -174.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.95 160.71 26.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.76 1.624 . . . . 0.0 109.09 -174.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 17.3 tpt -136.65 133.65 36.45 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 122.566 0.347 . . . . 0.0 110.717 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -126.93 152.68 35.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -140.26 173.88 11.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.14 11.81 75.17 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.396 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 47.7 mt -78.74 23.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 117.396 0.598 . . . . 0.0 111.181 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.27 10.5 p30 -74.24 26.85 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -173.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.46 156.55 45.18 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.282 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 25.6 m -68.44 -7.29 30.54 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.422 0.689 . . . . 0.0 112.362 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.27 -14.71 61.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 94.2 mmm -100.99 149.6 23.76 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.516 0.598 . . . . 0.0 111.586 -178.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -157.19 151.03 24.47 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.88 0.872 . . . . 0.0 109.336 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.0 p -59.27 -39.45 82.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -174.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -72.02 -34.82 69.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.316 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -76.09 -48.26 21.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.452 0.301 . . . . 0.0 111.499 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.5 p -67.42 -37.4 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -76.9 -32.06 57.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -171.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -76.2 -32.44 58.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 119.589 1.086 . . . . 0.0 110.114 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.21 -54.62 30.06 Favored 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.8 OUTLIER -76.52 -4.18 41.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 172.939 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.338 0.073 0 O-C-N 121.912 -0.492 . . . . 0.0 110.428 177.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 402' ' ' LEU . . . . . 0.416 ' C ' HD12 ' A' ' 402' ' ' LEU . 2.9 pp -58.11 -18.23 23.7 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.973 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -82.86 -10.48 58.82 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.94 -156.47 24.84 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 118.345 0.52 . . . . 0.0 112.287 -176.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -96.94 131.61 43.55 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.546 -0.385 . . . . 0.0 111.052 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.51 8.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -119.18 -70.68 0.78 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 14.8 pttp -154.48 168.36 26.97 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.2 p -137.32 149.8 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.187 0.995 . . . . 0.0 110.704 -177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -150.72 121.31 7.45 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.316 0.646 . . . . 0.0 111.51 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -85.21 158.92 20.22 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 13.4 mmt -116.37 133.49 55.95 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 32.3 mttp -79.36 -23.79 43.11 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 124.254 1.022 . . . . 0.0 111.619 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.3 t -77.81 -19.63 54.64 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -170.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -113.12 156.96 42.14 Favored Pre-proline 0 CA--C 1.527 0.094 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.32 -15.17 47.23 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.617 2.211 . . . . 0.0 110.451 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.27 106.09 0.2 Allowed Glycine 0 C--N 1.338 0.642 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 175.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.83 157.36 29.06 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.41 0.684 . . . . 0.0 110.044 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.12 156.42 21.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.599 0.237 . . . . 0.0 111.636 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 64.5 mtm -102.49 154.11 19.42 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.338 0.655 . . . . 0.0 109.75 171.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 12.0 t -140.27 115.13 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 122.88 0.472 . . . . 0.0 111.23 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -93.77 133.42 37.16 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 44.3 mtp -154.75 172.43 17.95 Favored 'General case' 0 C--N 1.335 -0.045 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -171.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.69 118.13 8.47 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 168.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -72.4 -33.37 67.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -167.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.17 -88.27 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -71.65 -30.62 65.94 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.17 -32.71 18.48 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.564 -0.855 . . . . 0.0 112.729 -173.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 61.1 t -88.38 -24.08 6.22 Favored 'Isoleucine or valine' 0 C--N 1.343 0.296 0 CA-C-N 119.987 1.267 . . . . 0.0 109.685 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -66.07 -50.82 62.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.408 172.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -64.27 -34.51 78.29 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.23 82.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.5 0.591 . . . . 0.0 110.296 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.1 mt -79.17 -8.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.223 0.609 . . . . 0.0 111.089 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 37.6 m -100.61 -18.79 16.41 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 177.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -125.73 -29.82 3.1 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 -169.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 94.6 mt -134.36 -10.06 2.52 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 120.449 1.477 . . . . 0.0 114.151 -170.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.655 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.2 p-10 -71.38 100.74 2.24 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.8 m-80 76.72 21.44 1.24 Allowed 'General case' 0 N--CA 1.479 1.025 0 O-C-N 117.795 -3.066 . . . . 0.0 112.477 -162.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -79.61 158.44 27.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 170.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.29 46.7 m-85 -72.85 42.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -174.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 441' ' ' MET . . . . . 0.422 ' HG2' ' CD2' ' A' ' 442' ' ' PHE . 16.0 ttt -59.74 145.98 43.14 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.791 -0.568 . . . . 0.0 110.43 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 442' ' ' PHE . . . . . 0.422 ' CD2' ' HG2' ' A' ' 441' ' ' MET 0.289 62.0 m-85 55.92 8.82 0.39 Allowed 'General case' 0 C--O 1.231 0.104 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 72.62 13.58 77.95 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -175.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -133.02 -4.41 3.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.672 0.736 . . . . 0.0 112.19 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 62.99 150.99 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.439 1.496 . . . . 0.0 114.069 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.55 110.4 7.19 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 171.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.5 m120 -65.61 130.33 42.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 115.885 -2.007 . . . . 0.0 112.061 -171.109 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.655 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.426 1.9 t -127.62 150.08 33.14 Favored 'Isoleucine or valine' 0 C--N 1.362 1.145 0 C-N-CA 113.031 -3.468 . . . . 0.0 116.249 169.136 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.7 t -161.04 172.38 16.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.778 1.231 . . . . 0.0 108.139 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.9 p -71.24 146.7 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 17.4 t -80.47 155.77 26.89 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 122.861 0.464 . . . . 0.0 111.192 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -103.43 -4.01 24.66 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 121.959 0.104 . . . . 0.0 111.068 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -82.93 156.18 67.43 Favored Pre-proline 0 N--CA 1.455 -0.181 0 C-N-CA 123.038 0.535 . . . . 0.0 110.276 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -74.84 -37.75 2.01 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.89 2.394 . . . . 0.0 112.144 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.89 163.16 11.57 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.511 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.7 mt -82.3 138.76 18.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 45.8 mmm -102.2 123.65 42.56 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 122.67 0.388 . . . . 0.0 110.506 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -73.7 153.47 48.69 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.19 2.593 . . . . 0.0 109.374 174.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.8 -123.81 1.39 Allowed Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.907 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -72.49 163.85 27.35 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.914 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 470' ' ' SER . 97.5 p -151.21 176.22 11.41 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.123 0.969 . . . . 0.0 109.351 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -136.93 7.08 2.93 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.335 -0.228 . . . . 0.0 111.127 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.55 -172.71 55.14 Favored Glycine 0 CA--C 1.526 0.734 0 O-C-N 122.202 -0.311 . . . . 0.0 112.47 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 75.2 mt -144.92 170.09 16.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.761 1.224 . . . . 0.0 109.586 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -70.09 -28.81 65.71 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.001 -0.437 . . . . 0.0 111.129 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -120.62 9.71 10.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -142.05 164.3 26.86 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 91.8 p -94.51 -22.56 18.16 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.592 0.357 . . . . 0.0 111.94 -176.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.5 t -127.01 146.88 50.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.878 0.471 . . . . 0.0 110.328 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' SER . . . . . 0.423 ' H ' ' HB2' ' A' ' 461' ' ' SER . 89.0 p -88.65 9.54 23.83 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.779 0.832 . . . . 0.0 110.838 176.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -141.34 150.7 42.81 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.002 1.321 . . . . 0.0 114.328 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -155.93 148.07 23.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.992 0.36 . . . . 0.0 111.099 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -100.74 146.35 27.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -140.38 1.45 1.77 Allowed 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 89.8 p -66.28 -19.35 65.79 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.337 0.655 . . . . 0.0 112.039 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -114.03 2.86 15.11 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.512 0.725 . . . . 0.0 111.152 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -76.15 150.03 37.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.976 0.417 . . . . 0.0 111.611 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -81.44 -11.88 59.1 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.538 0.735 . . . . 0.0 110.656 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -66.22 -18.12 65.16 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -63.33 131.1 47.19 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.718 0.407 . . . . 0.0 110.457 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.2 tpt85 -80.93 -33.77 33.83 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.318 62.9 m-85 -98.0 9.14 43.52 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 117.889 2.551 . . . . 0.0 117.889 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 28.2 m -75.53 -3.58 34.99 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.04 147.72 61.86 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -71.7 -24.77 21.29 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.269 2.646 . . . . 0.0 111.466 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -82.87 -25.78 32.21 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.003 0.365 . . . . 0.0 110.601 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -80.07 -43.94 20.93 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.143 -0.348 . . . . 0.0 110.185 173.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -58.76 -18.63 33.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.02 -19.24 44.31 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -124.05 8.13 8.62 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -65.13 154.11 38.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.135 0.425 . . . . 0.0 111.448 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -151.42 137.07 17.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 178.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.8 mm -141.55 140.57 31.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.058 0 C-N-CA 123.526 0.73 . . . . 0.0 109.39 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -149.42 169.28 21.23 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.07 0.948 . . . . 0.0 109.948 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -60.15 152.92 59.87 Favored Pre-proline 0 N--CA 1.455 -0.185 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.37 156.12 61.92 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.996 2.464 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 44.3 t -154.83 175.77 13.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.7 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -83.66 -4.86 58.95 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.283 -0.26 . . . . 0.0 110.423 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -94.01 138.2 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 176.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.45 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 82.9 mt -126.31 153.7 44.48 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.268 0.627 . . . . 0.0 109.855 175.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -124.0 131.1 53.52 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -123.93 158.41 32.05 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 -176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -143.75 150.59 38.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -174.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 50.93 57.09 7.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.748 1.219 . . . . 0.0 112.728 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.12 160.58 25.51 Favored Pre-proline 0 N--CA 1.454 -0.251 0 C-N-CA 123.594 0.758 . . . . 0.0 110.265 175.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.46 152.1 27.81 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.265 2.643 . . . . 0.0 112.535 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.57 -16.51 63.89 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.872 0.469 . . . . 0.0 111.934 -177.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -122.94 25.88 8.38 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.876 0.87 . . . . 0.0 110.751 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -64.61 -13.91 15.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.647 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.5 OUTLIER -54.81 -177.41 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -165.414 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.647 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.46 -39.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -169.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.0 mt-10 -59.74 -43.65 94.16 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 172.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.96 -28.78 21.25 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 122.181 2.264 . . . . 0.0 106.873 -174.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -66.98 -33.34 75.36 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -76.53 -42.19 44.03 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -73.2 -26.34 61.12 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 75.6 mt -76.9 -41.33 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.162 0.437 . . . . 0.0 110.902 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 89.8 m -68.34 -35.09 77.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.178 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -69.45 -38.49 77.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -71.1 -27.74 63.81 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.509 0.323 . . . . 0.0 111.533 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.8 mt -93.53 -4.1 51.64 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.8 0.44 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.07 32.56 58.4 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.943 -0.473 . . . . 0.0 112.626 175.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.6 m -127.03 164.68 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 117.554 0.677 . . . . 0.0 111.585 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.52 142.9 57.36 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -83.58 153.8 65.08 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.25 146.66 76.56 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 123.017 2.478 . . . . 0.0 110.729 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.1 t -85.01 -15.82 42.88 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.0 t -150.32 153.08 35.47 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.808 0.443 . . . . 0.0 109.878 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 72.8 t -141.67 145.3 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 123.39 0.676 . . . . 0.0 109.91 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -145.81 138.12 25.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.352 0.661 . . . . 0.0 109.365 176.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 18.4 t -141.77 140.16 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 C-N-CA 123.667 0.787 . . . . 0.0 110.393 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -155.36 169.08 25.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 -176.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.3 p -79.53 170.47 16.52 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.806 0.842 . . . . 0.0 111.485 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 82.68 -174.38 53.04 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.941 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 62.7 -19.44 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.151 1.78 . . . . 0.0 113.86 -177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 43.8 t -161.67 157.93 25.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 110.228 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -116.96 -7.77 11.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.505 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -88.14 -34.8 17.74 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 123.363 0.665 . . . . 0.0 112.237 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 4.0 m -160.59 170.68 20.38 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.016 0.526 . . . . 0.0 111.283 -173.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.4 t -79.89 165.5 22.61 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.44 0.696 . . . . 0.0 111.567 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.6 m -147.89 161.8 40.57 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.413 1.085 . . . . 0.0 109.588 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.56 -170.6 43.74 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.963 -178.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -119.16 159.96 23.01 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.943 0.897 . . . . 0.0 110.356 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.2 mt -141.46 159.79 41.49 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 108.94 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -150.26 149.22 29.86 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 117.782 0.264 . . . . 0.0 111.355 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' TRP . . . . . 0.45 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 13.0 m-90 -124.42 171.91 9.57 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 124.986 1.314 . . . . 0.0 112.48 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -74.48 -12.38 60.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.389 0.276 . . . . 0.0 110.478 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.5 t -157.51 156.06 31.37 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 121.707 -0.62 . . . . 0.0 111.135 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -23.24 63.45 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 122.256 -0.278 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 51.3 m -78.22 -25.29 46.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -78.09 -32.23 50.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.54 0.336 . . . . 0.0 110.708 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.07 -25.56 58.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.334 -0.228 . . . . 0.0 110.431 175.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 60.1 tp -74.66 -41.58 60.04 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.274 -0.266 . . . . 0.0 110.962 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.77 -35.74 75.16 Favored 'General case' 0 N--CA 1.456 -0.145 0 O-C-N 121.965 -0.459 . . . . 0.0 109.903 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.95 -23.57 55.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 177.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.84 -39.44 90.79 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.89 -37.35 88.08 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.339 27.7 m-85 -84.47 -4.59 59.02 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 118.85 2.907 . . . . 0.0 118.85 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 85.5 mt -122.15 -22.0 5.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.049 0.84 . . . . 0.0 113.09 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -70.85 139.17 50.77 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 119.369 0.986 . . . . 0.0 110.388 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 58.91 12.78 2.47 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.645 1.178 . . . . 0.0 112.968 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.268 36.6 t80 -71.25 140.8 50.52 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -72.2 137.8 47.14 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.156 -0.34 . . . . 0.0 111.704 -175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.9 mtm -83.41 145.28 29.08 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 122.356 0.263 . . . . 0.0 110.802 177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 60.4 pttt . . . . . 0 C--O 1.233 0.186 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.726 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.87 164.98 27.11 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.902 3.068 . . . . 0.0 111.96 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -130.0 142.3 50.65 Favored 'General case' 0 C--O 1.23 0.069 0 N-CA-C 102.618 -3.104 . . . . 0.0 102.618 173.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.262 0.7 OUTLIER -74.64 138.31 42.82 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.7 tt -89.59 147.1 24.12 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.34 158.53 43.88 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.574 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.93 169.36 23.67 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.232 0.539 . . . . 0.0 111.041 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 51.5 t -155.91 164.07 38.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.445 1.098 . . . . 0.0 109.377 -175.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -57.36 121.07 9.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 174.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 41.5 t -75.79 144.6 41.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -169.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 t -112.25 13.52 20.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.88 -1.054 . . . . 0.0 113.684 169.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.28 162.92 13.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.242 1.017 . . . . 0.0 111.909 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -87.35 -3.07 59.02 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.967 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -177.52 176.57 1.26 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.32 1.048 . . . . 0.0 110.081 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -137.19 23.3 3.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.657 0.783 . . . . 0.0 110.917 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.129 -1.415 . . . . 0.0 111.09 -177.195 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 N--CA 1.453 -0.903 0 N-CA-C 111.166 -0.359 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -151.93 156.4 40.0 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.233 0.613 . . . . 0.0 110.376 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.21 157.45 37.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.676 0.39 . . . . 0.0 110.836 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -83.35 6.69 19.02 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 30.0 t -154.28 145.05 16.11 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.119 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.0 Cg_exo -62.36 -7.39 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.911 3.074 . . . . 0.0 112.686 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.41 154.43 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -173.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.2 tt -132.36 154.55 49.64 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.76 1.624 . . . . 0.0 108.103 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 13.9 tpt -134.95 136.49 42.3 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.308 0.243 . . . . 0.0 110.949 -174.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -130.62 151.59 36.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -175.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -137.2 172.74 12.54 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.54 11.11 80.66 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.843 -0.421 . . . . 0.0 112.881 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.5 mt -77.97 28.04 0.18 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.802 0.801 . . . . 0.0 112.25 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.42 -39.17 91.8 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.61 148.69 51.56 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.094 0.473 . . . . 0.0 111.147 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.6 p -70.61 -6.72 38.84 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.887 0.875 . . . . 0.0 113.008 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -78.54 -13.45 59.82 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.61 0.364 . . . . 0.0 111.611 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 70.0 mmm -84.69 148.98 26.11 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -163.03 162.21 25.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 16.6 p -59.68 -32.31 70.37 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 122.112 -0.368 . . . . 0.0 111.267 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -73.29 -30.71 63.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 395' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 395' ' ' ARG . 1.0 OUTLIER -74.27 -51.67 14.62 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.463 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 12.5 m -65.03 -39.0 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.875 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.675 ' CE1' HG13 ' A' ' 406' ' ' VAL 0.358 1.9 m-85 -67.85 -51.89 43.04 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 175.678 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -58.08 -36.34 72.71 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.255 -173.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 28.5 t -60.4 -64.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.334 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.504 5.3 p90 -76.51 -5.82 49.17 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 118.226 2.676 . . . . 0.0 118.226 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.62 -32.42 53.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.998 0.519 . . . . 0.0 110.036 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -59.2 -17.73 30.25 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.008 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -89.87 -17.5 27.94 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.73 179.36 44.32 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 118.494 0.588 . . . . 0.0 112.941 -176.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -75.33 146.74 40.7 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -175.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.675 HG13 ' CE1' ' A' ' 397' ' ' PHE . 24.1 t -114.15 163.35 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.979 1.311 . . . . 0.0 113.206 -172.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.483 ' N ' HG12 ' A' ' 406' ' ' VAL . 64.1 mm-40 -132.87 -66.89 0.65 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.192 -0.432 . . . . 0.0 111.726 174.415 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -153.31 156.51 38.51 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.745 0.702 . . . . 0.0 112.833 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 409' ' ' VAL . . . . . 0.535 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.8 p -141.43 148.03 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 174.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -153.5 123.88 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.617 0.246 . . . . 0.0 111.312 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -74.76 162.37 28.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 66.4 mtm -135.11 126.67 28.8 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 121.347 0.594 . . . . 0.0 112.118 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -5.58 54.65 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 124.509 1.124 . . . . 0.0 111.801 176.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 91.6 p -77.96 -4.02 44.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.759 0.424 . . . . 0.0 111.208 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -138.49 158.51 70.35 Favored Pre-proline 0 CA--C 1.529 0.159 0 C-N-CA 124.492 1.117 . . . . 0.0 109.484 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.32 -13.68 40.93 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.149 2.566 . . . . 0.0 111.614 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.32 99.27 0.12 Allowed Glycine 0 C--N 1.336 0.534 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 175.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.94 156.76 35.1 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.814 0.446 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -155.95 146.28 21.68 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 111.219 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 81.4 mtp -88.61 147.84 24.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.1 t -142.13 118.5 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -102.34 134.17 46.06 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 70.0 mtp -153.71 173.91 15.21 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.472 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.58 116.96 7.38 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -72.25 -33.24 67.36 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -167.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.83 -87.35 0.02 OUTLIER Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -74.31 -24.42 59.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.93 -34.92 16.74 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.974 -176.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 69.9 t -84.84 -25.04 7.02 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 118.573 -1.251 . . . . 0.0 109.041 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -66.66 -54.29 24.72 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.913 0.324 . . . . 0.0 111.647 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -64.3 -37.21 86.7 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.52 -35.13 77.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.239 0.472 . . . . 0.0 110.786 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.67 -10.68 12.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.523 0.329 . . . . 0.0 110.919 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 58.6 m -96.76 -20.31 18.31 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -125.61 -31.48 2.97 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.483 HD23 HD22 ' A' ' 439' ' ' ASN . 90.8 mt -134.26 -7.26 2.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.333 1.424 . . . . 0.0 114.299 -169.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.1 p-10 -71.17 100.94 2.16 Favored 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 -170.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.2 m-80 76.92 21.23 1.18 Allowed 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 123.97 3.077 . . . . 0.0 112.156 -162.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 439' ' ' ASN . . . . . 0.483 HD22 HD23 ' A' ' 436' ' ' LEU . 55.7 t30 -84.76 159.44 20.47 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 169.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -75.85 138.8 41.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -160.25 145.58 14.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.566 0.746 . . . . 0.0 109.081 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 60.06 15.57 5.22 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.07 11.41 84.46 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -133.94 -161.44 1.14 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.608 1.563 . . . . 0.0 108.47 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.16 151.14 50.39 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 121.963 -0.461 . . . . 0.0 110.683 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -130.34 91.12 3.04 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.6 m120 -58.93 128.21 36.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 115.863 -2.018 . . . . 0.0 111.721 -173.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.42 1.9 t -128.21 150.47 33.98 Favored 'Isoleucine or valine' 0 C--N 1.367 1.348 0 C-N-CA 113.113 -3.435 . . . . 0.0 116.076 170.157 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 48.6 t -159.94 167.84 27.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.298 1.439 . . . . 0.0 108.618 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -70.74 148.93 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 21.4 t -85.01 158.13 20.56 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.783 0.433 . . . . 0.0 111.497 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -107.44 -1.33 21.57 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.386 0.275 . . . . 0.0 111.45 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -85.13 149.01 51.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.792 0.437 . . . . 0.0 110.621 175.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.47 -33.57 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.211 2.607 . . . . 0.0 112.542 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.07 157.79 11.71 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.064 0.393 . . . . 0.0 111.715 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 81.2 mt -83.39 145.23 8.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.4 mtp -114.75 126.98 27.26 Favored Pre-proline 0 CA--C 1.532 0.256 0 O-C-N 122.342 -0.224 . . . . 0.0 110.844 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.13 173.6 14.15 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 124.134 3.223 . . . . 0.0 110.286 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 136.63 -107.78 0.62 Allowed Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.034 -0.827 . . . . 0.0 111.034 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.37 158.34 35.96 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.326 0.65 . . . . 0.0 111.054 -177.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 40.6 t -161.1 163.81 31.15 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.8 0.84 . . . . 0.0 109.466 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -130.56 0.41 4.45 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.03 -177.3 54.37 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 122.934 0.302 . . . . 0.0 112.491 -178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.5 mt -143.7 157.75 44.17 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 124.343 1.057 . . . . 0.0 109.338 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 465' ' ' GLU . 10.5 pm0 -71.82 -10.22 59.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.779 0.431 . . . . 0.0 112.073 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -120.48 20.25 11.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.323 0.649 . . . . 0.0 110.237 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -168.35 -151.74 7.27 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.0 t -133.05 -16.1 2.52 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.8 p -127.06 146.82 50.23 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.374 0.669 . . . . 0.0 111.4 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 93.1 p -92.44 -0.11 57.39 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.862 0.465 . . . . 0.0 110.434 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -126.81 144.96 50.81 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -155.37 156.68 35.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.257 0.2 OUTLIER -136.69 142.74 43.15 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -129.24 12.33 6.03 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 32.2 t -64.04 -25.14 67.98 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.465 0.706 . . . . 0.0 112.013 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -114.0 3.84 15.49 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.351 0.661 . . . . 0.0 111.62 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 45.4 t -75.82 153.6 36.77 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 111.687 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 54.4 ttt180 -83.42 -14.48 52.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.259 0.624 . . . . 0.0 110.717 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -63.24 -22.29 66.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.121 0.568 . . . . 0.0 112.255 -174.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -58.03 130.83 48.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -68.88 -33.84 74.45 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -170.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.413 56.9 m-85 -98.0 17.35 18.53 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.1 t -61.58 -25.73 67.51 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -172.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.57 151.84 76.72 Favored Pre-proline 0 C--O 1.232 0.14 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -177.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.09 -15.66 39.77 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.006 2.471 . . . . 0.0 109.872 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.8 -32.73 60.0 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -80.6 -47.09 14.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 174.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.78 -21.43 65.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.94 -22.55 55.86 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.22 -0.3 . . . . 0.0 111.647 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -124.05 -1.81 8.24 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -60.25 153.93 21.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.425 0.557 . . . . 0.0 111.655 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -152.86 147.34 25.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.5 mm -135.82 147.55 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 C-N-CA 123.252 0.621 . . . . 0.0 109.578 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -156.56 160.54 39.56 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.019 0.528 . . . . 0.0 110.044 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -61.01 155.09 56.78 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.749 0.42 . . . . 0.0 109.999 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.68 146.67 89.13 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.099 2.533 . . . . 0.0 111.065 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 92.5 p -151.48 176.66 11.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.552 0.741 . . . . 0.0 109.627 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -83.71 -2.14 55.59 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.03 142.93 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 123.199 0.6 . . . . 0.0 112.124 175.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.2 tp -137.69 151.75 48.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -124.22 149.99 45.77 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.783 0.833 . . . . 0.0 109.149 -177.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -142.11 159.9 41.29 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.612 0.72 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -149.69 160.04 43.85 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 102.719 -3.067 . . . . 0.0 102.719 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 58.45 57.39 3.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.327 -0.233 . . . . 0.0 111.472 -174.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -123.17 148.51 54.9 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 122.589 0.356 . . . . 0.0 111.202 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.24 155.47 29.45 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.67 2.913 . . . . 0.0 112.794 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.16 -16.38 63.97 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.324 0.649 . . . . 0.0 111.724 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -120.33 20.95 11.85 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.69 0.796 . . . . 0.0 111.183 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.58 -13.91 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.82 -177.3 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -166.158 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -24.05 -40.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.6 mt-10 -58.53 -46.22 87.27 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.289 -1.338 . . . . 0.0 114.449 173.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -87.93 -27.96 21.8 Favored 'General case' 0 C--N 1.351 0.635 0 CA-C-N 122.653 2.479 . . . . 0.0 106.669 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -63.7 -38.07 89.72 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -75.6 -42.7 51.19 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -75.07 -20.91 59.29 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.132 -177.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -77.29 -39.92 28.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 118.268 0.486 . . . . 0.0 110.032 175.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.7 m -69.02 -31.39 70.17 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 122.137 -0.352 . . . . 0.0 110.838 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -72.7 -32.93 66.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.42 0.288 . . . . 0.0 110.692 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -71.74 -27.72 63.18 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.76 -5.96 37.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.818 0.281 . . . . 0.0 111.68 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.93 -7.83 8.91 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 123.678 0.656 . . . . 0.0 113.362 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.2 m -77.34 174.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 118.41 1.105 . . . . 0.0 112.784 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.73 164.52 6.07 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 123.295 0.638 . . . . 0.0 111.922 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -127.16 150.14 71.45 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.587 0.755 . . . . 0.0 109.281 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.11 154.68 69.92 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.095 2.53 . . . . 0.0 111.631 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.9 t -89.33 -17.11 29.56 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 17.3 t -155.48 155.27 33.17 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.523 0.329 . . . . 0.0 110.208 177.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.5 m -141.79 155.22 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -147.56 141.2 25.57 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.597 0.759 . . . . 0.0 109.473 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.33 141.91 29.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.302 0.641 . . . . 0.0 111.796 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -155.23 167.57 29.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -91.02 175.14 7.06 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.917 0.887 . . . . 0.0 110.785 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 95.26 177.07 37.55 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 123.591 0.615 . . . . 0.0 111.71 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 49.7 13.34 0.09 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.701 2.0 . . . . 0.0 114.432 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -160.85 157.65 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 123.797 0.839 . . . . 0.0 109.766 177.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -117.09 6.17 12.86 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -141.22 -10.62 0.96 Allowed 'General case' 0 C--N 1.341 0.198 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 45.2 t -154.31 163.85 39.5 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.463 0.574 . . . . 0.0 111.707 -170.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 60.1 p -90.11 173.63 8.07 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 111.349 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.5 m -145.72 165.8 27.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.595 1.158 . . . . 0.0 108.786 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.56 -174.27 46.06 Favored Glycine 0 CA--C 1.525 0.661 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.959 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.82 161.3 22.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.792 0.837 . . . . 0.0 110.299 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.1 mt -140.64 161.57 37.45 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.885 1.274 . . . . 0.0 108.784 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -148.05 149.76 32.68 Favored 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.936 0.346 . . . . 0.0 111.936 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -127.48 172.14 10.96 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.638 1.575 . . . . 0.0 112.333 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.21 -9.99 59.16 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.4 t -161.38 158.45 26.89 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.092 0.557 . . . . 0.0 110.339 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -73.52 -19.87 60.81 Favored 'General case' 0 CA--C 1.527 0.074 0 O-C-N 122.294 -0.254 . . . . 0.0 111.175 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 86.7 p -79.83 -25.48 40.78 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.92 0.327 . . . . 0.0 110.158 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -76.81 -35.85 57.33 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.323 0.249 . . . . 0.0 111.173 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.32 62.14 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 36.0 tp -73.89 -41.48 62.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.895 0.478 . . . . 0.0 110.12 178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -63.07 -47.07 84.49 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.061 0.457 . . . . 0.0 110.551 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -26.1 63.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 177.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.4 -38.9 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -63.78 -40.46 98.49 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.355 30.1 m-85 -91.13 -3.66 56.88 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 119.362 3.097 . . . . 0.0 119.362 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 74.5 mt -120.3 -4.86 9.92 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.498 1.045 . . . . 0.0 113.482 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -74.66 143.61 44.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.344 0.974 . . . . 0.0 108.54 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 58.07 19.28 5.87 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.591 0.757 . . . . 0.0 112.331 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -71.31 155.47 40.63 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -177.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -70.54 157.9 37.07 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.2 mtm -126.66 152.71 46.37 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.187 0.595 . . . . 0.0 111.917 173.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 169.061 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -83.57 169.25 12.35 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.616 2.877 . . . . 0.0 111.143 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -130.03 142.32 50.63 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 102.834 -3.024 . . . . 0.0 102.834 172.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -76.65 137.14 39.25 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 116.316 1.969 . . . . 0.0 116.316 -175.518 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.7 tt -87.42 150.03 24.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.437 1.095 . . . . 0.0 108.625 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -141.43 153.95 45.3 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.48 161.44 40.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.938 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.5 p -163.27 171.28 16.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.281 0.633 . . . . 0.0 111.626 -175.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -54.34 121.67 8.76 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.4 t -80.52 149.04 30.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -169.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 1.0 OUTLIER -111.68 9.22 20.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 169.545 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.41 168.75 15.4 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.261 1.025 . . . . 0.0 111.801 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -95.47 -3.12 47.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -175.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.74 178.03 4.24 Favored 'General case' 0 C--N 1.338 0.086 0 C-N-CA 123.346 0.659 . . . . 0.0 110.216 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.2 31.49 1.37 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.776 0.43 . . . . 0.0 111.768 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.252 1.192 0 CA-C-O 117.779 -1.105 . . . . 0.0 110.942 -178.879 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo . . . . . 0 N--CA 1.454 -0.821 0 CA-C-O 120.63 0.179 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -78.2 155.41 30.38 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.952 0.501 . . . . 0.0 110.017 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -71.93 155.47 40.32 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.808 0.337 . . . . 0.0 110.714 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -84.59 7.82 18.86 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 378' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 38.3 t -151.6 143.49 16.09 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 122.051 -0.406 . . . . 0.0 110.947 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 379' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 31.3 Cg_exo -63.12 -1.39 2.86 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.292 3.328 . . . . 0.0 113.976 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.4 p -143.01 156.24 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-O 121.809 0.814 . . . . 0.0 109.202 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.54 164.17 24.37 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.078 1.751 . . . . 0.0 107.825 -177.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.1 ttt -144.13 138.64 28.32 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.816 0.735 . . . . 0.0 111.855 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.7 154.54 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 C-N-CA 124.136 0.974 . . . . 0.0 108.588 -175.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -141.89 171.8 13.56 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.94 10.63 75.11 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 112.057 -0.417 . . . . 0.0 112.057 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 53.8 mt -79.03 26.51 0.25 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.761 0.78 . . . . 0.0 111.879 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -62.9 -35.57 80.49 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.455 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.7 pm0 -67.19 150.64 48.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.2 p -69.81 -7.17 37.63 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 123.687 0.795 . . . . 0.0 112.705 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -79.12 -7.39 58.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.367 0.667 . . . . 0.0 112.311 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 69.1 mmm -91.27 151.9 20.71 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.632 0.651 . . . . 0.0 111.259 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -159.54 155.51 26.49 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.574 0.75 . . . . 0.0 109.754 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 10.8 p -60.24 -38.36 83.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.29 -30.76 63.62 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -75.87 -43.28 46.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.656 0.382 . . . . 0.0 111.082 -177.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.488 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 1.1 m-85 -62.39 -53.39 55.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.099 2.259 . . . . 0.0 117.099 177.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -60.47 -32.49 71.45 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.351 -1.34 . . . . 0.0 109.787 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 11.0 t -60.92 -62.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.4 OUTLIER -76.54 -8.11 56.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 175.822 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.9 t -73.11 -29.66 63.08 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.917 -0.49 . . . . 0.0 109.951 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 402' ' ' LEU . . . . . 0.429 HD11 ' CE2' ' A' ' 403' ' ' TYR . 2.0 pp -60.18 -16.26 31.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.074 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 403' ' ' TYR . . . . . 0.429 ' CE2' HD11 ' A' ' 402' ' ' LEU . 52.2 m-85 -94.87 -6.86 41.77 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.104 2.261 . . . . 0.0 117.104 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.2 175.49 32.28 Favored Glycine 0 CA--C 1.527 0.844 0 CA-C-N 118.35 0.523 . . . . 0.0 112.85 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -70.35 137.31 50.47 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 111.719 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.488 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 15.1 m -114.03 165.31 9.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 124.959 1.304 . . . . 0.0 109.397 -176.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -139.39 -54.65 0.57 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -151.39 152.46 33.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.792 1.178 . . . . 0.0 112.972 -176.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 13.9 p -141.5 145.12 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 123.424 0.69 . . . . 0.0 109.914 176.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -153.6 128.23 9.37 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.872 0.469 . . . . 0.0 110.673 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -80.5 147.83 30.7 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 117.08 2.252 . . . . 0.0 117.08 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.1 mmt -83.3 128.55 34.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.431 0.692 . . . . 0.0 111.409 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 413' ' ' LYS . . . . . 0.539 ' HE3' ' CD1' ' A' ' 462' ' ' TYR . 36.6 mttp -79.3 -30.14 42.77 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 122.98 0.512 . . . . 0.0 111.108 173.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 28.4 t -79.77 -19.46 48.6 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.925 0.89 . . . . 0.0 112.956 -174.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -108.84 154.15 41.98 Favored Pre-proline 0 N--CA 1.455 -0.191 0 C-N-CA 123.068 0.547 . . . . 0.0 110.179 -175.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -67.96 -17.54 46.34 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.109 2.54 . . . . 0.0 111.293 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.45 103.68 0.17 Allowed Glycine 0 C--N 1.336 0.576 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -163.74 160.74 22.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.49 0.716 . . . . 0.0 109.385 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.47 143.11 16.06 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 79.4 mtp -81.18 149.55 29.05 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.3 t -142.68 102.05 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -84.51 134.38 34.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 75.0 mtp -153.6 171.46 18.73 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 123.723 0.809 . . . . 0.0 109.716 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.49 114.73 6.39 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 169.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -72.43 -33.87 67.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -166.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -52.49 -89.16 0.01 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.251 55.5 m-85 -77.93 -20.66 52.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 117.389 2.366 . . . . 0.0 117.389 -176.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -89.0 -35.76 16.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 119.021 -1.071 . . . . 0.0 111.673 -176.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.6 t -84.82 -26.67 6.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.221 0 C-N-CA 118.722 -1.191 . . . . 0.0 108.24 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -62.14 -62.88 1.46 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 173.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -65.83 -29.14 69.56 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.34 -36.13 78.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.736 0.698 . . . . 0.0 110.401 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 -11.49 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.907 0.483 . . . . 0.0 110.793 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.8 m -94.53 -21.85 18.6 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -130.13 -19.26 3.21 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -169.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.72 -12.33 2.3 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.669 1.577 . . . . 0.0 114.573 -175.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.51 100.98 2.35 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -169.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.1 m-80 76.91 22.05 1.1 Allowed 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 124.05 3.114 . . . . 0.0 113.21 -162.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.84 159.09 25.17 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.593 -0.692 . . . . 0.0 110.117 167.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.26 137.98 41.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 15.8 ttt -157.77 141.18 15.41 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.256 0.623 . . . . 0.0 109.665 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 58.55 16.65 4.39 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 81.63 11.3 83.18 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -132.66 -161.83 1.17 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.782 1.633 . . . . 0.0 108.373 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.78 149.23 49.06 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.886 -0.509 . . . . 0.0 110.8 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -126.39 82.36 2.07 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.446 0.698 . . . . 0.0 109.417 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.1 m120 -54.41 127.95 29.65 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 115.497 -2.192 . . . . 0.0 112.678 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.0 t -127.77 149.17 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 113.464 -3.294 . . . . 0.0 116.519 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.43 168.55 24.92 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.281 1.432 . . . . 0.0 107.653 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.89 150.07 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.1 t -88.62 157.98 18.4 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.133 0.573 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -105.51 -3.47 22.41 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.446 0.298 . . . . 0.0 111.182 178.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -75.49 156.58 85.12 Favored Pre-proline 0 CA--C 1.53 0.207 0 C-N-CA 123.259 0.624 . . . . 0.0 110.467 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.85 -35.47 0.99 Allowed 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.897 2.398 . . . . 0.0 112.193 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.57 167.94 9.47 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.393 0.677 . . . . 0.0 110.399 -175.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 65.5 mt -93.89 136.43 25.49 Favored 'Isoleucine or valine' 0 C--O 1.23 0.063 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 69.7 mmm -85.27 130.66 50.91 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-O 119.719 -0.182 . . . . 0.0 110.685 175.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -77.77 27.82 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.807 3.671 . . . . 0.0 111.341 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -74.54 -143.41 0.86 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.955 0.788 . . . . 0.0 113.535 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -72.53 166.95 21.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.727 0.811 . . . . 0.0 111.366 -174.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -146.11 175.46 10.46 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.928 0.891 . . . . 0.0 110.8 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.539 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 32.3 p90 -141.28 -178.4 5.58 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.734 0.813 . . . . 0.0 108.847 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.82 177.18 45.01 Favored Glycine 0 CA--C 1.528 0.867 0 O-C-N 122.031 -0.418 . . . . 0.0 113.02 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 28.0 mt -140.94 168.61 19.37 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 124.24 1.016 . . . . 0.0 109.745 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -71.78 -31.22 66.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.325 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -120.57 18.47 12.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.768 0.427 . . . . 0.0 110.442 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.28 172.99 42.43 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.495 -0.753 . . . . 0.0 112.444 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 95.0 p -99.77 -16.61 18.04 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.99 136.97 52.98 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.25 0.477 . . . . 0.0 111.013 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 94.8 p -83.63 -0.5 50.84 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.113 0.965 . . . . 0.0 111.634 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.265 4.0 t80 -131.24 149.16 52.69 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -155.27 150.47 26.96 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -177.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.285 0.3 OUTLIER -129.89 140.94 50.88 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 178.149 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.48 7.52 10.1 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 39.3 t -65.34 -19.62 66.04 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.983 0.513 . . . . 0.0 111.764 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -113.91 2.26 15.01 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.126 0.57 . . . . 0.0 111.539 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.1 t -80.74 151.96 28.58 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.67 0.388 . . . . 0.0 111.349 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -81.64 -13.41 57.97 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.705 0.402 . . . . 0.0 111.191 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -59.52 -23.53 62.89 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -57.35 113.1 1.61 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.25 0.62 . . . . 0.0 109.775 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -75.32 -29.73 60.11 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.31 64.7 m-85 -98.0 15.03 25.31 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 43.8 t -71.34 -18.36 62.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -132.65 151.36 78.01 Favored Pre-proline 0 C--O 1.233 0.216 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.26 -32.51 62.03 Favored 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.345 2.697 . . . . 0.0 112.667 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -78.68 -27.33 45.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.115 0.416 . . . . 0.0 110.496 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -74.44 -41.13 61.37 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 174.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -63.43 -17.06 62.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.35 -0.218 . . . . 0.0 111.386 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -87.16 -10.54 52.43 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -124.02 -10.17 7.66 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -63.83 155.67 29.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -152.61 146.26 25.05 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 44.7 mm -123.21 149.32 26.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 C-N-CA 123.505 0.722 . . . . 0.0 109.516 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -156.02 155.95 33.58 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.823 0.449 . . . . 0.0 109.852 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -59.8 156.94 31.67 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.917 0.487 . . . . 0.0 109.906 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -62.91 142.67 89.25 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.182 1.922 . . . . 0.0 108.905 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.6 t -154.5 167.07 31.28 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.915 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -83.68 -2.54 56.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.802 0.441 . . . . 0.0 110.718 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.33 140.13 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.503 0.721 . . . . 0.0 112.403 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.9 mt -128.85 156.47 43.59 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.065 0.546 . . . . 0.0 110.118 176.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -115.65 150.23 37.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -137.46 154.98 49.82 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -151.57 166.83 29.97 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 102.959 -2.978 . . . . 0.0 102.959 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 56.55 57.53 4.78 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.003 -0.436 . . . . 0.0 111.663 -174.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -133.0 148.92 71.33 Favored Pre-proline 0 N--CA 1.454 -0.248 0 C-N-CA 122.427 0.291 . . . . 0.0 110.61 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.42 161.06 47.38 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.003 2.468 . . . . 0.0 110.917 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.61 -16.38 63.83 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.485 0.314 . . . . 0.0 111.008 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -100.44 12.18 37.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.404 0.682 . . . . 0.0 111.532 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.33 -18.22 23.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.706 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.1 m -55.07 -177.27 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.811 -1.09 . . . . 0.0 113.686 -166.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.706 ' H ' HG22 ' A' ' 510' ' ' THR . 23.4 pt-20 -23.09 -41.18 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -169.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.7 mt-10 -57.86 -47.22 83.35 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 173.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -88.04 -27.91 21.7 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 122.356 2.343 . . . . 0.0 106.296 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.33 -37.27 86.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -75.27 -42.23 55.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.65 -24.22 49.49 Favored 'General case' 0 CA--C 1.526 0.024 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.222 -177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.04 -41.7 52.45 Favored 'Isoleucine or valine' 0 C--N 1.337 0.052 0 CA-C-N 118.864 0.756 . . . . 0.0 109.984 176.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 99.7 m -65.98 -26.99 67.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.056 -0.403 . . . . 0.0 110.853 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -70.17 -41.31 73.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -71.35 -24.46 62.1 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -89.24 -5.96 57.21 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.313 0.245 . . . . 0.0 111.212 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 69.19 -7.45 3.35 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 123.702 0.668 . . . . 0.0 113.867 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.4 m -83.9 172.83 1.0 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-N 118.459 1.129 . . . . 0.0 113.33 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.8 152.05 32.53 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.292 1.037 . . . . 0.0 113.077 -174.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 47.3 mtm105 -95.59 149.92 36.75 Favored Pre-proline 0 CA--C 1.529 0.141 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.828 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -69.74 150.29 68.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.137 2.558 . . . . 0.0 110.658 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -92.19 -14.11 29.55 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.6 t -152.58 155.52 37.53 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.358 0.263 . . . . 0.0 110.716 176.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 61.0 t -145.3 145.68 20.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 123.688 0.795 . . . . 0.0 111.31 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -147.36 142.34 26.98 Favored 'General case' 0 CA--C 1.526 0.056 0 C-N-CA 123.894 0.877 . . . . 0.0 109.334 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.69 143.03 31.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 122.981 0.513 . . . . 0.0 111.218 -176.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.1 p90 -155.67 -178.31 7.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 69.9 m -131.42 177.69 7.3 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 110.858 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.95 -5.78 59.76 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.792 0.711 . . . . 0.0 112.689 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -93.22 -20.34 20.54 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-N 117.886 0.843 . . . . 0.0 111.167 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 36.9 t -164.45 155.27 15.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.23 0.612 . . . . 0.0 110.432 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.98 -7.93 31.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.463 0.305 . . . . 0.0 110.517 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -89.23 -31.52 17.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.5 p -160.83 168.53 24.52 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.458 0.646 . . . . 0.0 112.287 -172.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 29.8 t -81.36 167.22 19.71 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.611 1.164 . . . . 0.0 111.379 178.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -146.72 159.74 43.1 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 124.373 1.069 . . . . 0.0 109.518 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.99 -173.82 45.7 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.84 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -119.27 159.76 23.48 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.413 0.685 . . . . 0.0 110.693 -177.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.7 mt -140.61 159.26 42.58 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.081 1.352 . . . . 0.0 108.414 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.99 149.1 29.18 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.979 -0.451 . . . . 0.0 111.183 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -124.04 171.0 10.1 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 125.027 1.331 . . . . 0.0 112.479 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -73.63 -12.66 60.81 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.803 0.441 . . . . 0.0 111.487 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.7 t -157.19 160.15 38.43 Favored 'General case' 0 C--N 1.339 0.115 0 O-C-N 121.687 -0.633 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.84 -29.89 68.31 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.201 0.2 . . . . 0.0 110.822 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 89.7 p -76.4 -26.01 55.14 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -74.85 -35.42 62.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.336 0.255 . . . . 0.0 110.932 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.04 -37.18 66.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.17 -37.66 78.3 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.236 -0.29 . . . . 0.0 110.247 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -62.0 -45.71 92.42 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.093 0.473 . . . . 0.0 110.264 176.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.6 m -69.9 -28.18 65.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.09 -35.7 81.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.14 -44.82 90.36 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.464 -0.631 . . . . 0.0 111.888 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -89.65 -24.6 21.6 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.33 -18.62 20.63 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -173.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.38 152.36 39.56 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.621 -0.674 . . . . 0.0 110.428 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.49 17.28 4.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.023 1.329 . . . . 0.0 113.182 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -69.75 139.3 53.31 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -75.85 138.9 41.41 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.863 -0.523 . . . . 0.0 111.945 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.3 mtm -83.49 152.66 24.82 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.125 0.488 . . . . 0.0 111.624 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.226 0 C-N-CA 124.175 0.99 . . . . 0.0 113.062 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.5 p90 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 159.77 52.18 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.601 2.201 . . . . 0.0 111.348 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.39 142.29 50.84 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 102.542 -3.133 . . . . 0.0 102.542 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.276 0.7 OUTLIER -78.15 138.53 38.76 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -176.029 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.47 150.79 25.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.977 1.311 . . . . 0.0 108.203 172.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.06 152.78 46.47 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.986 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 10.8 mt -132.27 164.91 25.37 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.822 0.849 . . . . 0.0 111.144 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 47.6 t -159.17 154.42 25.42 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.742 0.817 . . . . 0.0 109.21 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -59.93 117.06 4.61 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 174.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.3 t -73.0 146.95 45.6 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -169.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -112.32 10.82 19.99 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 169.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.3 162.54 17.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.619 0.768 . . . . 0.0 111.321 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -86.17 -3.8 59.04 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.727 -175.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.24 178.07 1.44 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.674 1.19 . . . . 0.0 109.576 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -133.23 16.62 4.1 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.866 0.467 . . . . 0.0 111.682 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.261 179.718 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo . . . . . 0 N--CA 1.455 -0.754 0 N-CA-C 111.598 -0.193 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -155.9 153.68 30.04 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.027 0.442 . . . . 0.0 111.09 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.22 163.4 25.81 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.142 0.577 . . . . 0.0 111.185 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -74.09 -7.11 51.37 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.6 t -159.05 148.26 14.55 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.495 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.61 -14.56 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.349 2.7 . . . . 0.0 110.737 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.61 149.84 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -137.24 152.95 50.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.792 1.237 . . . . 0.0 108.225 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -133.96 133.44 41.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.398 -0.189 . . . . 0.0 110.512 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -129.91 152.04 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.086 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -140.74 173.13 11.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.72 10.71 78.69 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.437 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.6 mt -80.69 25.13 0.44 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.464 0.705 . . . . 0.0 112.201 -178.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -65.38 -39.87 92.78 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -175.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.6 pm0 -67.28 149.66 50.08 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.133 0.492 . . . . 0.0 111.143 -178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 88.0 p -68.26 -8.63 41.07 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -77.71 -20.37 53.67 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 118.116 0.416 . . . . 0.0 111.182 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 64.9 mmm -82.06 147.87 28.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 122.178 -0.326 . . . . 0.0 110.252 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.07 155.78 25.8 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -60.71 -30.5 70.0 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -71.81 -40.03 69.44 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 61.0 mtt85 -76.05 -41.12 51.72 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 -175.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.58 -43.66 77.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -176.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -76.83 -29.54 55.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.429 -0.796 . . . . 0.0 109.198 -169.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -78.84 -30.21 45.08 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 119.991 1.269 . . . . 0.0 110.0 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -54.77 29.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.557 2.4 p90 -76.72 -7.34 55.17 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 172.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.7 t -69.28 -26.39 64.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 78.8 mt -54.4 -24.36 19.48 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -92.94 -11.07 34.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -173.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 170.68 176.87 40.32 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 118.205 0.457 . . . . 0.0 112.199 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -68.61 136.28 52.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.853 0.359 . . . . 0.0 111.683 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.06 165.52 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -119.97 -70.96 0.76 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.449 0.3 . . . . 0.0 111.238 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -154.44 170.68 20.81 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 9.2 p -146.03 149.37 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.369 1.068 . . . . 0.0 110.513 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -155.8 137.86 14.58 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.353 0.661 . . . . 0.0 111.075 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.4 m-85 -88.23 156.53 19.17 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 21.9 mmt -98.38 118.86 36.0 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 122.879 0.472 . . . . 0.0 111.882 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -14.42 59.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.148 0.179 . . . . 0.0 110.686 169.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 98.9 p -84.23 1.3 45.25 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.752 0.821 . . . . 0.0 112.377 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -139.38 155.66 72.03 Favored Pre-proline 0 CA--C 1.528 0.115 0 C-N-CA 123.665 0.786 . . . . 0.0 110.134 -177.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -68.34 -16.08 43.15 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.174 2.583 . . . . 0.0 111.647 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.77 93.77 0.09 OUTLIER Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.41 161.55 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.467 0.707 . . . . 0.0 109.329 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.49 151.25 25.91 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.129 0.49 . . . . 0.0 111.958 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 36.8 ttm -96.11 147.29 23.88 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.6 t -141.17 152.46 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -138.56 133.69 32.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 42.6 mtp -152.36 174.17 14.16 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.346 1.058 . . . . 0.0 109.053 -171.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.85 124.25 21.97 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -72.53 -32.26 65.96 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.744 -1.222 . . . . 0.0 114.164 -166.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.07 -90.84 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 O-C-N 124.559 1.162 . . . . 0.0 110.775 -176.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.296 64.7 m-85 -75.85 -20.24 58.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.2 -33.99 15.98 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 118.569 -1.253 . . . . 0.0 111.371 -175.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.6 t -86.97 -26.96 5.89 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 C-N-CA 118.238 -1.385 . . . . 0.0 109.057 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -67.5 -51.37 52.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.651 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -65.49 -35.83 82.06 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.965 -0.46 . . . . 0.0 112.111 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.29 83.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.604 0.638 . . . . 0.0 110.417 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.5 mt -77.13 -14.15 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 122.848 0.459 . . . . 0.0 110.899 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 15.5 m -94.7 -19.78 20.11 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 114.452 1.279 . . . . 0.0 114.452 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -126.07 -27.99 3.21 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.9 mt -134.38 -8.94 2.55 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -172.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.635 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 33.0 p-10 -70.27 105.32 2.94 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -168.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.3 m-80 75.15 22.08 1.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 116.788 -3.695 . . . . 0.0 115.055 -164.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -77.36 161.45 28.03 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.307 -0.871 . . . . 0.0 109.707 167.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -79.62 138.37 37.4 Favored 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 177.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.2 ttt -159.51 136.95 9.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.289 0.636 . . . . 0.0 110.174 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.389 52.0 m-85 57.32 26.65 12.66 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.02 9.79 86.69 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.261 -0.735 . . . . 0.0 111.261 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -135.84 -164.67 1.58 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.019 1.328 . . . . 0.0 108.779 -178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.46 147.22 52.13 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.698 0.285 . . . . 0.0 111.33 -176.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.5 ptm -118.57 75.6 1.03 Allowed 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 124.477 1.111 . . . . 0.0 109.171 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.3 m120 -53.7 127.19 24.71 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 115.979 -1.963 . . . . 0.0 112.265 -173.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.635 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.2 t -126.71 152.06 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 113.537 -3.265 . . . . 0.0 115.877 169.557 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 43.2 t -160.74 165.74 29.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.523 1.529 . . . . 0.0 108.324 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.14 147.93 11.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 O-C-N 121.56 -0.713 . . . . 0.0 112.56 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.4 t -88.14 157.72 18.75 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 122.827 0.451 . . . . 0.0 111.35 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -97.55 -5.66 35.26 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.087 0.155 . . . . 0.0 110.652 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -77.84 152.57 80.2 Favored Pre-proline 0 N--CA 1.456 -0.153 0 C-N-CA 123.546 0.739 . . . . 0.0 111.029 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.56 -36.06 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.363 2.709 . . . . 0.0 112.139 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.99 159.69 9.5 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.358 0.663 . . . . 0.0 110.707 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.23 132.41 32.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 37.0 mmm -100.33 126.24 36.76 Favored Pre-proline 0 N--CA 1.454 -0.24 0 C-N-CA 122.454 0.301 . . . . 0.0 110.707 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.62 153.79 44.03 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.186 2.591 . . . . 0.0 109.102 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 167.81 -127.8 1.62 Allowed Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.86 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -72.45 172.95 9.51 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.1 p -156.36 172.3 18.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.044 0.538 . . . . 0.0 110.215 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -137.16 4.44 2.7 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.0 -176.2 53.93 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 56.0 mt -145.65 168.76 19.9 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.053 0.941 . . . . 0.0 109.916 -178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.4 pm0 -65.3 -31.38 72.49 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.065 0.546 . . . . 0.0 110.364 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -120.5 10.02 11.04 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.47 172.82 30.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.739 -0.545 . . . . 0.0 111.739 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 92.0 p -101.72 -15.03 17.11 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 122.89 0.476 . . . . 0.0 111.997 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.11 145.69 50.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.864 0.465 . . . . 0.0 110.171 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 78.6 p -85.49 10.4 13.1 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.396 0.678 . . . . 0.0 111.301 177.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -138.18 149.9 46.26 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.29 150.98 30.35 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 120.801 0.334 . . . . 0.0 110.485 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -124.09 138.37 54.44 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.156 0.983 . . . . 0.0 113.577 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.23 2.53 5.18 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 95.9 p -66.11 -15.91 63.5 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.123 0.569 . . . . 0.0 112.158 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -113.98 -0.38 14.1 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.05 0.54 . . . . 0.0 111.369 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 68.6 m -79.84 150.83 30.54 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.599 0.36 . . . . 0.0 111.522 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -79.47 -12.56 59.88 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.987 0.515 . . . . 0.0 111.193 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.18 -18.99 62.62 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -176.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -61.75 115.04 3.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -73.06 -31.52 64.45 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.447 0.299 . . . . 0.0 111.59 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.29 61.1 m-85 -97.93 17.4 18.31 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 42.6 t -64.43 -20.9 66.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 0.8 OUTLIER -137.86 151.39 70.28 Favored Pre-proline 0 C--O 1.231 0.129 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -178.386 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.3 Cg_endo -70.55 -23.59 27.01 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.111 2.541 . . . . 0.0 111.923 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -80.13 -20.15 45.61 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.255 0.48 . . . . 0.0 110.705 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -85.73 -39.7 16.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 172.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.96 64.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.761 0.424 . . . . 0.0 111.996 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.27 -21.36 53.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -124.08 7.74 8.59 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.03 156.63 38.32 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.453 0.57 . . . . 0.0 111.913 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -118.6 146.47 44.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.553 0.741 . . . . 0.0 110.728 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.3 mm -143.57 138.29 25.64 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.21 159.3 35.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -58.81 154.91 34.24 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -65.16 146.57 87.04 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.32 2.013 . . . . 0.0 109.073 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -155.95 170.95 20.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.309 0.244 . . . . 0.0 110.636 -173.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -83.7 -1.19 53.56 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.569 0.348 . . . . 0.0 111.034 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.77 137.57 29.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.5 mt -123.32 161.48 24.58 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.232 0.613 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -130.17 143.76 50.97 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.736 1.214 . . . . 0.0 108.316 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.86 163.24 30.69 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.445 0.64 . . . . 0.0 112.067 -177.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -149.31 162.53 39.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 57.1 57.36 4.61 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.736 0.414 . . . . 0.0 111.727 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -121.64 151.27 56.82 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 122.686 0.394 . . . . 0.0 111.989 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.84 152.61 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.585 2.857 . . . . 0.0 112.921 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.61 -16.43 63.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.173 0.589 . . . . 0.0 111.444 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -123.05 25.62 8.44 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.394 0.677 . . . . 0.0 110.696 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.79 -12.59 14.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.657 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.91 -177.31 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.865 -1.065 . . . . 0.0 113.854 -165.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.657 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -26.46 -37.27 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -169.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.3 mt-10 -58.22 -47.38 83.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 117.07 -1.443 . . . . 0.0 114.559 171.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -88.19 -26.7 22.26 Favored 'General case' 0 C--N 1.353 0.718 0 CA-C-N 122.732 2.514 . . . . 0.0 107.113 -173.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -67.63 -34.49 77.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.503 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -75.2 -42.86 54.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -76.19 -21.34 56.58 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.802 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.96 -40.6 26.86 Favored 'Isoleucine or valine' 0 C--N 1.339 0.113 0 CA-C-N 118.423 0.556 . . . . 0.0 109.954 175.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 87.7 m -68.4 -34.59 76.31 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.958 -0.464 . . . . 0.0 110.933 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.16 -38.1 84.88 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -70.54 -28.39 64.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 122.114 -0.366 . . . . 0.0 111.032 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -92.51 -4.12 54.07 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.263 0.625 . . . . 0.0 111.519 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.58 -2.0 59.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.15 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.0 t -77.1 153.55 5.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 118.072 0.936 . . . . 0.0 112.182 178.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -68.36 151.68 46.52 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.399 . . . . 0.0 110.294 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.9 ptt85 -78.07 156.14 79.56 Favored Pre-proline 0 CA--C 1.53 0.2 0 C-N-CA 122.685 0.394 . . . . 0.0 110.365 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.06 154.29 72.93 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.111 2.541 . . . . 0.0 110.386 173.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.3 t -85.39 -17.28 37.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.1 t -156.97 152.72 27.0 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.558 0.343 . . . . 0.0 110.173 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.1 m -143.44 154.73 16.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 123.719 0.808 . . . . 0.0 112.35 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -150.75 144.33 25.05 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.181 0.592 . . . . 0.0 109.973 176.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -138.08 150.73 24.85 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 C-N-CA 123.398 0.679 . . . . 0.0 112.218 177.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -152.83 174.84 13.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.7 t -142.96 168.91 18.59 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.556 0.742 . . . . 0.0 109.624 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 115.15 -16.47 17.74 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 123.857 0.741 . . . . 0.0 111.985 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -80.91 -26.48 36.74 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 117.795 0.797 . . . . 0.0 111.131 175.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.2 t -163.9 157.35 18.58 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.747 0.819 . . . . 0.0 109.686 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -96.99 -6.89 34.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.539 0.336 . . . . 0.0 110.532 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -78.18 -41.54 34.33 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 32.5 t -161.13 163.56 31.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -170.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -90.36 167.32 12.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.096 0.958 . . . . 0.0 111.702 -177.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.3 m -145.44 165.66 27.91 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 124.996 1.318 . . . . 0.0 108.748 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.69 -170.77 43.92 Favored Glycine 0 CA--C 1.525 0.701 0 C-N-CA 120.554 -0.832 . . . . 0.0 113.322 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.03 159.84 26.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.036 0.934 . . . . 0.0 110.228 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.51 156.91 45.7 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 124.588 1.155 . . . . 0.0 109.085 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -148.18 149.38 31.87 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 117.925 0.33 . . . . 0.0 111.664 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.0 m-90 -126.81 172.53 10.3 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 124.828 1.251 . . . . 0.0 112.152 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -76.13 -9.59 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.666 0.386 . . . . 0.0 110.556 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.9 t -158.4 158.93 35.15 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.623 -0.673 . . . . 0.0 111.669 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -69.45 -24.9 63.87 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 122.368 0.267 . . . . 0.0 110.502 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 49.2 m -77.91 -27.49 49.53 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -74.31 -32.15 62.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -77.83 -25.91 49.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.7 tp -77.38 -37.16 52.66 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.199 0.199 . . . . 0.0 111.317 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -75.61 -38.54 58.92 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.591 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.264 0.2 OUTLIER -71.6 -22.28 61.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 12.1 tp -67.91 -37.44 81.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 170.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.11 -30.46 76.93 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.315 11.5 m-85 -101.32 -2.57 30.72 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 84.6 mt -125.05 -3.63 7.56 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.287 0.948 . . . . 0.0 113.29 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -79.88 139.58 37.08 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.739 1.154 . . . . 0.0 109.586 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 56.74 19.37 4.32 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 175.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -77.86 149.96 34.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 104.103 -2.555 . . . . 0.0 104.103 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -78.34 143.38 36.96 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.719 0.408 . . . . 0.0 111.992 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.1 mtm -83.57 152.65 24.75 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 111.259 175.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.138 0.975 . . . . 0.0 111.295 177.966 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.254 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -77.58 164.22 28.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 123.751 2.967 . . . . 0.0 111.675 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -129.93 142.29 50.67 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 172.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.02 141.96 32.76 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -82.3 146.1 29.61 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 172.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.14 148.48 49.76 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 117.829 0.286 . . . . 0.0 110.237 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.3 pp -154.99 165.46 36.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.181 0.515 . . . . 0.0 111.811 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 31.3 p -159.8 174.42 14.51 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.971 0.908 . . . . 0.0 109.887 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -61.04 126.43 27.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.4 t -84.29 156.09 22.11 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -172.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -122.08 11.78 10.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.317 1.047 . . . . 0.0 113.604 170.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.58 162.92 14.59 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.087 0.955 . . . . 0.0 111.659 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -85.73 -3.23 58.84 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.65 178.21 3.18 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.027 0.931 . . . . 0.0 109.359 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -132.41 16.43 4.47 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.987 0.515 . . . . 0.0 111.465 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.614 -1.184 . . . . 0.0 110.492 -179.861 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 N--CA 1.456 -0.727 0 N-CA-C 110.816 -0.494 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -146.33 158.32 43.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.819 0.448 . . . . 0.0 110.539 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.41 160.65 31.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.623 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -78.95 -3.43 44.89 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.379 0.672 . . . . 0.0 110.576 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -155.12 148.64 18.61 Favored Pre-proline 0 C--O 1.233 0.21 0 O-C-N 121.726 -0.609 . . . . 0.0 112.058 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -61.33 -5.84 5.89 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 124.246 3.297 . . . . 0.0 113.029 172.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 153.33 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.091 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.7 tt -128.07 154.49 45.64 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.655 1.582 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.9 tpt -137.4 133.55 34.9 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 117.847 0.294 . . . . 0.0 110.971 -175.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.54 153.44 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -146.12 170.48 16.61 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 87.72 6.94 75.83 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.669 -0.517 . . . . 0.0 113.07 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.05 45.28 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.106 0.962 . . . . 0.0 111.372 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -82.04 -13.47 57.29 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -174.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -83.76 147.14 27.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.672 0.389 . . . . 0.0 110.176 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 91.1 p -72.67 -7.32 49.81 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -81.47 -17.4 48.85 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.651 0.38 . . . . 0.0 111.353 -177.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 92.5 mmm -83.66 162.63 20.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.351 0.596 . . . . 0.0 111.487 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -167.74 168.76 12.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.612 1.565 . . . . 0.0 106.79 176.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -61.67 -34.25 75.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.379 0.536 . . . . 0.0 110.95 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -74.74 -29.51 61.19 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -74.23 -51.54 15.09 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 122.127 -0.358 . . . . 0.0 111.052 -175.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.7 p -72.6 -37.61 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -73.37 -32.06 64.29 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.13 -48.37 80.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 118.897 0.771 . . . . 0.0 111.403 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 31.0 t -56.69 -55.63 18.63 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 1.4 p90 -76.52 -5.8 49.11 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 29.0 t -77.4 -34.05 54.9 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.699 -0.626 . . . . 0.0 111.657 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 402' ' ' LEU . . . . . 0.478 ' C ' HD12 ' A' ' 402' ' ' LEU . 2.7 pp -62.66 -12.23 22.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 119.916 -0.714 . . . . 0.0 111.597 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.81 2.77 40.8 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 169.94 -144.38 8.48 Favored Glycine 0 CA--C 1.525 0.688 0 O-C-N 121.805 -0.559 . . . . 0.0 112.008 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -116.17 131.65 56.88 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.9 m -113.94 165.59 8.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -175.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -118.42 -65.95 1.12 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.563 0.345 . . . . 0.0 111.662 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 408' ' ' LYS . . . . . 0.458 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 36.2 mtmm -150.57 169.3 21.87 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.325 0.511 . . . . 0.0 111.914 -173.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.9 p -146.78 147.83 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 123.95 0.9 . . . . 0.0 109.264 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -154.63 140.74 18.44 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.582 0.353 . . . . 0.0 111.118 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.281 5.2 m-85 -94.44 156.52 16.44 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 117.052 2.242 . . . . 0.0 117.052 -178.162 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.4 mmt -93.75 125.17 38.22 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.008 0.523 . . . . 0.0 112.234 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.12 -14.32 59.2 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 124.311 1.044 . . . . 0.0 111.802 176.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 90.4 p -97.18 1.25 49.59 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.364 0.666 . . . . 0.0 112.483 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -131.44 152.81 81.15 Favored Pre-proline 0 CA--C 1.53 0.196 0 C-N-CA 123.165 0.586 . . . . 0.0 110.293 -175.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -71.07 -14.68 32.08 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.303 2.669 . . . . 0.0 111.737 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.21 90.81 0.08 OUTLIER Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.63 156.23 37.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.91 154.01 29.06 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.945 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.2 ptm -107.64 150.01 27.4 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 9.4 t -141.18 130.33 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -173.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -107.18 131.93 53.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 47.6 mtp -153.29 171.29 18.79 Favored 'General case' 0 C--O 1.231 0.092 0 C-N-CA 123.211 0.605 . . . . 0.0 109.377 -172.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.79 115.89 6.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 169.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -72.35 -33.44 67.27 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.78 -87.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -75.07 -25.56 58.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -175.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.35 -36.09 16.8 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.053 -174.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.57 -26.45 6.5 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.042 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -64.43 -53.4 49.01 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 117.981 0.355 . . . . 0.0 111.947 173.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -69.91 -29.18 66.29 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.01 80.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.599 0.636 . . . . 0.0 110.144 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.0 mt -78.6 -15.44 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.147 0.579 . . . . 0.0 110.73 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 45.3 m -91.37 -20.82 21.42 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.453 ' C ' HD22 ' A' ' 436' ' ' LEU . 97.1 m-70 -132.55 -24.35 2.01 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -169.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 435' ' ' HIS . 4.1 mm? -128.91 -12.14 4.75 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.731 1.605 . . . . 0.0 113.78 -172.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.606 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.5 p-10 -71.79 101.07 2.51 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -168.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.56 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 17.3 m-80 78.85 21.82 0.69 Allowed 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 123.643 2.928 . . . . 0.0 113.639 -160.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -81.09 157.85 25.24 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.469 -0.769 . . . . 0.0 109.073 167.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -78.58 139.05 38.64 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.9 ttt -154.17 133.96 12.98 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 442' ' ' PHE . . . . . 0.404 ' CZ ' ' CD1' ' A' ' 558' ' ' PHE 0.356 53.5 m-85 56.69 22.6 6.98 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 -176.509 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.81 11.03 66.19 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.741 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -146.38 146.4 30.62 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 117.775 0.788 . . . . 0.0 111.002 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -77.61 149.95 34.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.996 0.518 . . . . 0.0 111.361 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.1 ptt? -131.48 83.67 2.12 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.494 0.717 . . . . 0.0 109.281 176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.56 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 28.9 t-20 -54.66 129.26 35.96 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.163 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.606 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.461 2.1 t -123.79 150.61 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 113.118 -3.433 . . . . 0.0 115.953 168.417 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 33.8 t -160.82 172.01 17.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.538 1.135 . . . . 0.0 108.211 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -73.23 147.19 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.6 t -86.78 155.68 20.22 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.226 0.61 . . . . 0.0 111.491 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -92.88 -7.53 45.96 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -77.58 145.7 71.91 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.049 0.94 . . . . 0.0 110.34 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.7 -33.87 2.11 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.019 2.48 . . . . 0.0 111.388 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.91 161.66 10.89 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.458 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 64.5 mt -83.61 129.03 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 mmm -91.93 122.41 65.29 Favored Pre-proline 0 N--CA 1.454 -0.257 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 174.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.81 144.02 47.35 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.665 2.243 . . . . 0.0 108.827 174.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 169.69 -134.56 3.22 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.582 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -72.55 160.9 31.52 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.371 0.669 . . . . 0.0 111.369 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.3 p -145.03 171.94 13.77 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.461 1.104 . . . . 0.0 109.546 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -133.65 -0.49 3.18 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.35 179.78 51.14 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 112.172 -0.371 . . . . 0.0 112.172 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 81.9 mt -143.37 154.19 43.48 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.864 0.866 . . . . 0.0 109.25 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -75.26 -4.08 36.97 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.447 0.299 . . . . 0.0 110.98 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -120.43 11.11 11.34 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.223 1.009 . . . . 0.0 113.698 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -163.74 -144.84 4.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.056 -1.218 . . . . 0.0 110.056 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 97.6 p -133.0 -24.52 1.89 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.269 0.534 . . . . 0.0 112.138 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.2 t -127.06 149.73 49.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.754 0.421 . . . . 0.0 110.286 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.2 p -91.7 9.89 30.57 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.28 0.632 . . . . 0.0 110.856 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -143.92 150.9 39.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -155.22 157.68 37.7 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.606 0.241 . . . . 0.0 110.363 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -133.31 133.69 42.88 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -176.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.64 1.43 9.46 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.7 p -72.86 -6.91 48.15 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.545 0.738 . . . . 0.0 111.314 -179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -113.95 16.79 18.23 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.885 0.874 . . . . 0.0 111.528 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -139.03 150.92 46.35 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.87 6.48 41.69 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.909 0.884 . . . . 0.0 112.185 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -63.5 -25.72 68.39 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -67.32 150.37 49.1 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -69.9 -33.78 72.65 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.337 -0.545 . . . . 0.0 112.071 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.418 56.6 m-85 -98.08 10.19 41.04 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 177.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.4 t -69.24 -21.66 63.91 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -171.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 1.1 p -133.3 150.86 76.4 Favored Pre-proline 0 CA--C 1.529 0.145 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -175.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.8 Cg_endo -70.53 -23.5 27.22 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.168 2.579 . . . . 0.0 112.0 -177.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -73.76 -24.11 59.82 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.452 0.569 . . . . 0.0 110.217 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -83.21 -52.72 6.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 174.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.25 -20.39 64.19 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.762 0.825 . . . . 0.0 112.622 -171.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.51 60.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 117.943 0.338 . . . . 0.0 111.634 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -124.03 6.65 8.59 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.61 155.44 15.52 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.492 0.587 . . . . 0.0 112.233 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -152.98 147.23 25.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.0 mm -136.61 151.45 28.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 C-N-CA 123.379 0.671 . . . . 0.0 109.734 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -155.99 158.02 37.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -61.84 154.94 64.92 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -62.39 144.06 94.44 Favored 'Trans proline' 0 N--CA 1.449 -1.096 0 C-N-CA 122.811 2.341 . . . . 0.0 109.909 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.9 t -153.45 -179.99 8.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -83.73 0.01 48.98 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.989 -0.444 . . . . 0.0 110.802 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.0 t -100.18 137.24 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.3 mt -125.59 159.81 31.19 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 109.134 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -128.81 147.03 50.76 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -133.52 159.89 39.07 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -150.62 163.57 38.19 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 56.93 43.49 24.63 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.154 -0.341 . . . . 0.0 111.537 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.52 150.8 39.44 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.13 153.46 32.71 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.448 2.765 . . . . 0.0 112.673 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 507' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 507' ' ' LEU . 3.7 mm? -68.55 -16.52 63.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.079 0.552 . . . . 0.0 111.581 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -122.95 24.07 9.11 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.514 0.726 . . . . 0.0 110.98 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.8 p -64.29 -13.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.665 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.76 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -165.836 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -25.55 -37.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -169.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.1 mt-10 -58.37 -48.69 79.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 117.244 -1.36 . . . . 0.0 114.22 171.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -86.21 -27.16 24.67 Favored 'General case' 0 C--N 1.352 0.68 0 CA-C-N 122.407 2.367 . . . . 0.0 106.747 -173.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -64.57 -39.81 94.41 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -71.97 -42.45 66.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.35 -26.85 56.15 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.042 -1.063 . . . . 0.0 111.155 -177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.9 mt -70.55 -39.61 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 CA-C-N 118.825 0.739 . . . . 0.0 110.456 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.04 -34.16 77.45 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.012 -0.43 . . . . 0.0 110.786 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -70.77 -27.19 63.74 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -80.53 -8.55 59.62 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.354 0.261 . . . . 0.0 111.618 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.4 mt -114.91 -2.88 12.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.738 0.415 . . . . 0.0 111.578 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.28 0.35 56.96 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 119.78 -0.455 . . . . 0.0 112.271 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.0 148.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 CA-C-N 117.778 0.789 . . . . 0.0 110.851 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -69.55 145.5 52.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 120.89 0.376 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 -71.26 150.68 94.4 Favored Pre-proline 0 N--CA 1.455 -0.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.412 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.2 158.73 56.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.841 3.028 . . . . 0.0 111.095 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -90.9 -23.13 20.59 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.6 m -154.13 152.16 30.1 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.979 0.511 . . . . 0.0 111.119 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.04 156.56 19.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.76 0.824 . . . . 0.0 112.993 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -153.67 143.25 21.73 Favored 'General case' 0 C--O 1.228 -0.046 0 C-N-CA 122.918 0.487 . . . . 0.0 109.824 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.29 149.33 25.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.498 0.719 . . . . 0.0 112.207 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -156.45 -171.52 3.73 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.3 t -140.68 -176.65 4.73 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.872 0.869 . . . . 0.0 109.948 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.8 74.44 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.847 0.737 . . . . 0.0 111.967 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -96.36 -17.03 20.94 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 117.429 0.614 . . . . 0.0 111.279 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 48.3 t -164.05 151.55 12.27 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.3 0.64 . . . . 0.0 110.082 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.06 -7.77 31.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.667 0.387 . . . . 0.0 110.546 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -86.68 -33.72 19.97 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.603 0.761 . . . . 0.0 112.465 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 96.4 p -162.89 173.37 13.79 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.076 0.465 . . . . 0.0 111.48 -169.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.4 t -88.31 166.69 14.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.485 0.714 . . . . 0.0 110.934 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.1 p -149.69 162.86 39.39 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.382 1.073 . . . . 0.0 108.427 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.44 -172.79 45.67 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.572 -177.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -113.3 159.45 19.36 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.595 0.758 . . . . 0.0 110.321 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 15.0 tp -145.64 152.19 39.25 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.963 0.905 . . . . 0.0 108.726 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -150.44 148.65 29.01 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-N 119.197 0.908 . . . . 0.0 112.921 -174.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -123.47 175.73 6.6 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 125.245 1.418 . . . . 0.0 112.802 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.61 -5.38 57.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 40.7 t -158.31 155.73 29.35 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.195 0.598 . . . . 0.0 110.61 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -72.67 -24.21 60.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.521 0.328 . . . . 0.0 111.12 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.8 p -79.16 -24.12 43.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.931 0.332 . . . . 0.0 110.442 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -76.99 -31.6 56.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.424 0.29 . . . . 0.0 111.385 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.77 -28.04 58.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.34 -39.78 62.59 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.162 -0.336 . . . . 0.0 111.073 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -70.15 -36.77 74.97 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.483 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.3 m -69.79 -27.8 65.2 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.87 -38.26 90.17 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.82 -38.32 94.25 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 558' ' ' PHE . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 442' ' ' PHE 0.298 8.0 m-85 -92.44 -3.0 55.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 119.214 3.042 . . . . 0.0 119.214 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 37.4 mt -133.92 -6.71 2.75 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -69.76 143.22 53.07 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 120.46 1.482 . . . . 0.0 108.991 176.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 60.49 18.94 8.72 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.119 0.968 . . . . 0.0 113.271 178.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 34.5 t80 -70.13 135.3 49.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.51 139.32 47.53 Favored 'General case' 0 C--O 1.23 0.069 0 O-C-N 122.001 -0.437 . . . . 0.0 112.168 -174.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.52 152.45 24.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.296 175.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 10.5 ptmm? . . . . . 0 CA--C 1.53 0.191 0 C-N-CA 123.839 0.856 . . . . 0.0 110.624 176.471 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.91 164.26 25.31 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 124.005 3.137 . . . . 0.0 111.792 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -129.88 142.33 50.68 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 102.006 -3.331 . . . . 0.0 102.006 171.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.274 0.6 OUTLIER -81.95 137.15 35.21 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -174.227 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -78.11 135.1 37.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.49 151.19 49.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.2 pp -151.38 166.48 30.91 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.489 0.662 . . . . 0.0 110.962 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 578' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 402' ' ' LEU . 45.2 t -159.81 163.0 34.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.781 0.832 . . . . 0.0 109.359 -174.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -57.52 124.74 20.04 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 172.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 34.0 t -75.1 149.03 39.22 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -170.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.271 0.6 OUTLIER -116.86 9.67 13.92 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 170.788 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.05 163.39 22.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.204 1.002 . . . . 0.0 111.816 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -92.5 -3.05 55.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.513 -178.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -155.14 174.61 14.96 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 123.572 0.749 . . . . 0.0 110.491 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.44 18.78 1.88 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.045 0.938 . . . . 0.0 109.855 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.221 -1.371 . . . . 0.0 110.918 -177.414 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.455 -0.752 0 N-CA-C 111.101 -0.384 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -156.66 159.69 38.65 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.746 0.418 . . . . 0.0 110.721 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.15 163.26 28.22 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.781 0.433 . . . . 0.0 111.209 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -71.53 -9.59 58.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.77 148.4 12.49 Favored Pre-proline 0 CA--C 1.53 0.21 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.162 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.13 -18.73 45.55 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.554 2.836 . . . . 0.0 112.085 172.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -87.6 153.32 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.5 tt -143.08 154.04 43.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.246 1.018 . . . . 0.0 108.907 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 77.3 mmm -132.01 141.73 49.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.62 0.368 . . . . 0.0 111.292 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.11 150.6 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -141.36 173.45 11.48 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 -175.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.56 8.59 80.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.849 -0.5 . . . . 0.0 111.849 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 29.06 0.19 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.696 0.798 . . . . 0.0 112.248 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.14 -37.3 86.98 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 388' ' ' GLN . 8.3 pm0 -67.35 149.61 50.08 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 33.8 t -70.45 -9.75 57.32 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.301 0.64 . . . . 0.0 112.582 -175.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -71.4 -21.21 62.03 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 121.897 -0.502 . . . . 0.0 111.621 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 55.1 mmm -82.29 145.93 29.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.078 -0.389 . . . . 0.0 110.696 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -160.27 156.07 25.82 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.256 1.022 . . . . 0.0 108.452 177.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.8 p -59.99 -29.23 68.32 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -70.97 -42.44 69.72 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.201 0.455 . . . . 0.0 111.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -75.98 -42.7 47.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -175.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.5 t -69.45 -42.24 80.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.409 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 2.3 t80 -76.9 -32.88 57.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -169.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 398' ' ' ASN . . . . . 0.418 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.5 p30 -74.17 -29.36 61.74 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 120.012 1.278 . . . . 0.0 109.897 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -59.67 -59.2 4.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.552 0.7 OUTLIER -76.65 -3.48 38.09 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 174.35 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 33.1 t -74.66 -37.77 62.63 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.873 -0.517 . . . . 0.0 111.323 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.37 -16.99 51.81 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -9.81 59.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 117.118 2.266 . . . . 0.0 117.118 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -174.03 -128.99 1.13 Allowed Glycine 0 CA--C 1.525 0.666 0 O-C-N 121.903 -0.498 . . . . 0.0 112.347 -175.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -138.08 127.0 23.98 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.563 0.745 . . . . 0.0 109.035 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.409 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.0 OUTLIER -114.07 165.57 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -175.176 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -122.35 -57.21 1.77 Allowed 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -154.52 162.55 41.09 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -142.8 152.54 17.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 124.474 1.11 . . . . 0.0 109.793 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -157.47 140.73 15.42 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -90.17 167.56 12.62 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 ptp -142.91 133.58 25.2 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 121.359 0.599 . . . . 0.0 111.7 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -5.66 54.62 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.648 1.179 . . . . 0.0 112.338 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 83.1 p -77.74 -1.23 30.24 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -140.24 156.37 69.98 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 124.452 1.101 . . . . 0.0 109.093 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -67.15 -12.57 36.49 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.181 2.587 . . . . 0.0 111.739 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.9 97.36 0.11 Allowed Glycine 0 C--N 1.337 0.621 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.33 159.82 37.88 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.963 0.505 . . . . 0.0 110.372 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -154.54 155.67 35.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.971 0.415 . . . . 0.0 111.048 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 43.7 ttm -108.98 148.76 30.24 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.479 1.112 . . . . 0.0 109.008 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.0 t -138.7 153.26 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 123.308 0.643 . . . . 0.0 111.431 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -140.8 132.52 27.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.332 0.515 . . . . 0.0 110.797 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 9.7 ptp -162.56 176.14 10.71 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.353 1.061 . . . . 0.0 110.535 -172.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.46 120.81 12.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 174.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -72.36 -33.47 67.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.42 -86.55 0.02 OUTLIER Glycine 0 CA--C 1.517 0.172 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.264 72.9 m-85 -74.78 -25.57 59.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -86.78 -37.19 18.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.905 -175.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.3 t -82.36 -32.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.339 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -69.22 -41.02 77.58 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -68.2 -38.61 82.15 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.52 0.6 . . . . 0.0 111.844 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -64.45 -35.29 80.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.277 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 51.5 mt -77.65 -15.89 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.184 0.594 . . . . 0.0 111.177 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 28.4 m -93.67 -19.47 21.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -133.67 -20.46 2.03 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 116.558 2.059 . . . . 0.0 116.558 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.36 -12.88 2.39 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 120.795 1.634 . . . . 0.0 114.648 -172.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.604 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.2 p-10 -71.47 100.96 2.32 Favored 'General case' 0 C--O 1.201 -1.471 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -168.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.9 m-80 78.63 22.05 0.72 Allowed 'General case' 0 N--CA 1.484 1.256 0 O-C-N 117.614 -3.179 . . . . 0.0 114.051 -161.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -74.16 162.8 28.59 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.428 -0.795 . . . . 0.0 109.706 167.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -80.22 142.45 34.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 172.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.6 ttt -158.64 134.28 8.81 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.352 45.6 m-85 58.39 11.04 1.5 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 97.44 3.71 58.5 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -128.96 -165.01 1.45 Allowed 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.184 0.994 . . . . 0.0 108.933 176.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -126.1 149.88 48.6 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 122.683 0.393 . . . . 0.0 111.31 -177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.2 ptm -124.62 75.57 1.42 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.231 1.012 . . . . 0.0 109.637 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -51.98 127.06 20.2 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 115.618 -2.134 . . . . 0.0 112.821 -174.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.604 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.439 2.1 t -126.29 152.17 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 113.21 -3.396 . . . . 0.0 115.952 169.161 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.46 167.27 17.73 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.028 1.331 . . . . 0.0 109.069 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.94 147.48 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 40.4 t -87.49 159.78 18.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.901 0.481 . . . . 0.0 111.865 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -100.5 -8.04 23.55 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.377 0.271 . . . . 0.0 110.6 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -76.79 150.54 81.67 Favored Pre-proline 0 N--CA 1.455 -0.202 0 C-N-CA 123.477 0.711 . . . . 0.0 111.104 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.99 -36.11 1.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.558 2.839 . . . . 0.0 112.178 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.37 157.68 9.24 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.198 0.599 . . . . 0.0 110.726 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.02 142.96 13.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 78.7 mtp -115.27 126.78 27.43 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 122.072 0.149 . . . . 0.0 111.346 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.88 168.28 23.76 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.79 2.994 . . . . 0.0 109.875 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.47 -135.3 4.77 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -72.33 157.35 37.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.17 0.588 . . . . 0.0 109.663 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 470' ' ' SER . 96.6 p -148.79 177.88 9.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.593 0.357 . . . . 0.0 110.72 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -122.17 4.47 9.79 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 81.98 -177.54 53.8 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 54.8 mt -144.65 168.14 20.89 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 124.057 0.943 . . . . 0.0 109.911 -178.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.3 pm0 -66.16 -31.1 71.74 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.203 0.601 . . . . 0.0 110.447 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -120.51 12.11 11.5 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -155.95 172.11 33.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 112.044 -0.423 . . . . 0.0 112.044 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.9 m -100.42 -18.39 16.74 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 10.6 p -127.13 154.31 44.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.306 0.643 . . . . 0.0 111.457 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' SER . . . . . 0.448 ' H ' ' HB2' ' A' ' 461' ' ' SER . 90.0 p -83.64 -3.55 57.83 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 122.777 0.431 . . . . 0.0 111.424 178.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.25 2.3 t80 -121.11 150.2 41.6 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -175.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -152.76 151.47 30.53 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.734 0.302 . . . . 0.0 111.131 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -119.36 138.04 53.33 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.07 5.01 4.14 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 115.969 1.841 . . . . 0.0 115.969 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 46.7 t -66.63 -28.48 68.51 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.746 0.418 . . . . 0.0 111.449 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -95.98 -6.66 38.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.892 0.477 . . . . 0.0 111.32 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.2 t -80.45 146.99 31.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.602 0.361 . . . . 0.0 111.201 -178.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -91.28 4.43 52.35 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.48 0.312 . . . . 0.0 111.106 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -63.93 -22.91 67.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.792 0.269 . . . . 0.0 111.017 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -60.81 134.16 56.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.501 0.72 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.7 tpt85 -80.96 -33.62 33.76 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -176.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.302 56.4 m-85 -97.99 11.95 35.84 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.685 2.476 . . . . 0.0 117.685 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 79.9 p -73.64 -10.35 59.61 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -172.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -136.47 147.81 61.42 Favored Pre-proline 0 N--CA 1.461 0.117 0 N-CA-C 115.405 1.631 . . . . 0.0 115.405 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.7 Cg_exo -64.77 -31.91 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.035 2.49 . . . . 0.0 112.392 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -79.15 -23.58 43.87 Favored 'General case' 0 CA--C 1.528 0.104 0 O-C-N 122.352 -0.218 . . . . 0.0 111.03 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -83.53 -41.34 18.06 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -61.33 -20.3 62.79 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.673 0.389 . . . . 0.0 111.874 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.75 -17.86 57.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -123.96 9.0 8.71 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -64.06 152.36 40.54 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.442 0.564 . . . . 0.0 111.998 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -143.85 125.97 15.49 Favored 'General case' 0 C--O 1.23 0.076 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.1 mm -143.38 -20.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.441 0.696 . . . . 0.0 110.838 -175.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 12.0 pm0 -65.4 160.67 21.44 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.513 0.725 . . . . 0.0 111.608 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 51.68 50.04 7.89 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 124.436 1.094 . . . . 0.0 113.893 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.67 146.6 84.54 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.634 2.223 . . . . 0.0 109.291 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 17.0 t -159.73 -157.91 0.61 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -175.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -83.74 0.6 46.52 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.319 0.648 . . . . 0.0 110.88 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 4.5 t -88.8 139.4 17.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 C-N-CA 123.337 0.655 . . . . 0.0 112.309 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.44 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 67.7 mt -122.19 156.63 33.31 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.458 0.703 . . . . 0.0 109.556 174.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -122.98 141.5 51.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -134.08 159.1 41.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.624 0.726 . . . . 0.0 110.706 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -151.51 163.37 39.16 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 103.093 -2.928 . . . . 0.0 103.093 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.48 57.33 4.42 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.551 0.341 . . . . 0.0 111.271 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -127.92 150.32 73.19 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.589 0.356 . . . . 0.0 111.1 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.37 153.36 34.66 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.7 2.933 . . . . 0.0 112.993 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 60.6 mt -68.54 -16.72 63.97 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.433 0.693 . . . . 0.0 112.506 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -122.81 23.84 9.28 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.838 0.855 . . . . 0.0 111.329 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.3 p -65.85 -12.01 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.709 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.35 -176.86 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -166.112 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.709 ' H ' HG22 ' A' ' 510' ' ' THR . 22.6 pt-20 -23.39 -41.49 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.0 -48.55 78.19 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 117.107 -1.425 . . . . 0.0 114.082 172.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -87.78 -27.59 22.22 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 122.481 2.4 . . . . 0.0 106.919 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -63.28 -37.74 88.43 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.308 -0.957 . . . . 0.0 113.521 175.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -73.47 -43.34 60.41 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.35 -21.17 56.47 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 119.99 -0.684 . . . . 0.0 111.823 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.7 mt -74.93 -37.6 41.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 174.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.5 m -66.22 -37.07 84.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.052 -0.405 . . . . 0.0 110.618 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -70.61 -26.86 63.69 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -74.98 -26.31 59.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.494 0.318 . . . . 0.0 110.831 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 82.2 mt -98.47 -5.26 32.72 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.05 0.54 . . . . 0.0 111.509 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.83 -1.37 54.25 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.406 0.527 . . . . 0.0 112.861 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.9 m -77.87 159.48 4.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 117.734 0.767 . . . . 0.0 112.527 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -69.38 146.14 52.34 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 123.014 0.526 . . . . 0.0 111.221 -178.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -74.73 154.43 87.25 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.727 0.811 . . . . 0.0 111.44 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.76 157.19 61.24 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.382 2.722 . . . . 0.0 110.33 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -90.16 -17.15 28.13 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.1 t -158.88 155.21 27.33 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.653 0.381 . . . . 0.0 110.624 177.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.7 m -142.84 153.83 17.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 C-N-CA 123.637 0.775 . . . . 0.0 113.039 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -150.19 142.29 24.03 Favored 'General case' 0 N--CA 1.458 -0.055 0 C-N-CA 123.479 0.712 . . . . 0.0 109.71 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.39 150.79 22.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -155.81 178.83 9.82 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 94.5 p -141.66 169.78 16.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.476 0.71 . . . . 0.0 110.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 116.91 -16.91 13.29 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 123.937 0.78 . . . . 0.0 111.959 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -84.71 -24.61 28.83 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 117.522 0.661 . . . . 0.0 112.285 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.6 t -163.13 155.41 18.29 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.937 0.495 . . . . 0.0 110.153 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.79 -7.64 33.18 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.598 0.359 . . . . 0.0 110.722 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.13 -31.67 44.21 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 95.8 p -165.47 170.44 14.43 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.051 0.453 . . . . 0.0 111.724 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 47.5 t -86.26 163.82 17.52 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.6 0.76 . . . . 0.0 110.16 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 68.4 m -141.99 161.38 38.12 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.978 0.911 . . . . 0.0 108.68 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.44 43.56 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 119.888 -1.149 . . . . 0.0 113.309 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -118.77 158.35 25.75 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.782 0.833 . . . . 0.0 110.229 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 84.3 mt -141.1 157.92 44.64 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 124.594 1.157 . . . . 0.0 108.645 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -147.62 150.27 34.1 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.359 0.527 . . . . 0.0 111.567 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' TRP . . . . . 0.44 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 15.7 m-90 -126.48 164.23 21.62 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.514 1.126 . . . . 0.0 112.202 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.01 -11.05 60.6 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.0 t -156.01 162.04 40.38 Favored 'General case' 0 C--N 1.339 0.138 0 O-C-N 121.536 -0.728 . . . . 0.0 111.57 -178.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -65.55 -31.82 73.07 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 122.887 0.475 . . . . 0.0 110.333 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 79.1 p -76.42 -28.46 56.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.215 0.206 . . . . 0.0 110.728 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -73.6 -34.44 65.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.62 -30.62 61.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 175.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 49.7 tp -74.92 -38.82 61.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 122.331 0.252 . . . . 0.0 111.334 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -74.1 -40.08 62.95 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.844 -0.535 . . . . 0.0 110.044 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.8 -24.67 62.61 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -68.23 -34.87 77.03 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 171.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -68.97 -32.43 73.34 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.491 -0.616 . . . . 0.0 112.302 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.287 8.2 m-85 -95.59 -9.7 31.53 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.92 -11.19 11.54 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-N 119.082 0.856 . . . . 0.0 113.254 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -74.38 138.68 43.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 119.153 0.888 . . . . 0.0 109.331 178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 60.36 22.51 12.03 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.581 0.752 . . . . 0.0 112.484 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 29.1 t80 -81.54 145.77 30.5 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -73.8 144.58 45.51 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.78 -0.575 . . . . 0.0 111.869 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 65.5 mtm -83.54 152.54 24.84 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 172.04 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.1 p90 . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.87 162.08 43.02 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.466 2.777 . . . . 0.0 111.031 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.93 142.34 50.66 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.47 131.18 44.34 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -174.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.75 147.99 24.94 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.277 1.031 . . . . 0.0 109.347 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -140.8 154.11 46.1 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.793 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -158.59 161.37 37.24 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 27.0 p -158.36 174.82 14.55 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.495 0.718 . . . . 0.0 110.254 -176.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -59.73 124.26 19.56 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 30.2 t -85.67 150.35 24.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -110.38 9.25 23.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.66 163.37 16.51 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.609 0.764 . . . . 0.0 111.827 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 -89.58 -3.08 58.46 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.98 178.02 4.11 Favored 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 123.415 0.686 . . . . 0.0 110.142 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -136.72 18.83 3.06 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.74 0.416 . . . . 0.0 111.568 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.501 -1.238 . . . . 0.0 110.526 179.946 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 N--CA 1.454 -0.809 0 CA-C-O 120.831 0.263 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -155.38 160.33 40.61 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 110.893 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.98 161.41 31.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.828 0.451 . . . . 0.0 111.134 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -70.6 -5.08 26.61 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.55 145.68 10.97 Favored Pre-proline 0 N--CA 1.456 -0.127 0 O-C-N 122.183 -0.323 . . . . 0.0 111.446 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.78 -18.69 62.03 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.672 2.915 . . . . 0.0 111.626 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 5.3 t -94.57 153.68 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 C-N-CA 123.607 0.763 . . . . 0.0 112.194 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -141.09 153.52 45.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.271 1.028 . . . . 0.0 108.789 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 74.1 mmm -130.39 133.73 46.6 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 122.91 0.484 . . . . 0.0 111.695 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.75 151.78 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.22 177.99 8.22 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 105.38 -2.082 . . . . 0.0 105.38 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 82.3 12.04 81.25 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 112.034 -0.427 . . . . 0.0 112.034 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 48.8 mt -78.24 26.26 0.21 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.514 0.657 . . . . 0.0 112.203 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -64.37 -37.89 89.1 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -176.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.451 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.6 pm0 -67.07 150.42 49.22 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.182 0.515 . . . . 0.0 111.055 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -70.04 -8.71 51.52 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.666 0.786 . . . . 0.0 112.974 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -76.85 -13.88 59.95 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.73 0.412 . . . . 0.0 111.676 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 56.4 mmm -85.07 152.15 23.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.963 0.411 . . . . 0.0 111.099 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.73 155.37 23.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 175.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 393' ' ' CYS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 411' ' ' PHE . 24.2 p -57.42 -32.0 66.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -175.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.06 -47.97 63.96 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 175.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.9 mtt85 -70.55 -39.11 74.17 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 116.821 -0.172 . . . . 0.0 110.972 -171.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.74 -46.35 74.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -77.68 -28.65 51.17 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.712 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -77.31 -29.11 53.51 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.392 0.997 . . . . 0.0 110.097 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 399' ' ' VAL . . . . . 0.576 HG22 HD12 ' A' ' 556' ' ' LEU . 2.7 t -59.93 -56.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.555 2.3 p90 -76.66 -3.21 36.65 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 173.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.503 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.4 t -73.01 -36.87 67.08 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.866 -0.521 . . . . 0.0 110.559 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.15 -11.67 22.11 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.779 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -89.22 -3.79 58.44 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.95 -169.82 41.05 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 118.795 0.725 . . . . 0.0 112.91 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -78.46 114.28 17.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 401' ' ' CYS . 2.5 m -114.09 165.49 9.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -127.87 -59.49 1.19 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -154.42 167.81 28.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -172.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.1 150.42 15.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 124.827 1.251 . . . . 0.0 109.84 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -151.54 128.78 11.21 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 123.353 0.661 . . . . 0.0 110.805 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 411' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 393' ' ' CYS . 3.3 m-85 -82.84 156.95 23.35 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 117.396 2.369 . . . . 0.0 117.396 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.17 127.77 37.77 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.712 0.405 . . . . 0.0 110.846 175.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 413' ' ' LYS . . . . . 0.578 ' H ' ' CD ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.21 -29.14 42.66 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.849 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 52.2 p -102.02 -19.51 15.17 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -80.5 154.27 73.9 Favored Pre-proline 0 CA--C 1.528 0.129 0 CA-C-N 118.456 0.571 . . . . 0.0 110.047 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.84 -15.87 48.39 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.085 2.523 . . . . 0.0 111.136 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 166.66 98.19 0.12 Allowed Glycine 0 C--N 1.336 0.538 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 176.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.17 37.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.334 0.654 . . . . 0.0 110.209 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.75 148.85 19.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 62.8 mtp -85.03 150.77 24.64 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.348 1.059 . . . . 0.0 109.037 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.89 146.39 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 C-N-CA 123.48 0.712 . . . . 0.0 110.414 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.44 ' C ' ' HG3' ' A' ' 423' ' ' MET . 71.4 tt0 -129.42 129.81 45.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.374 0.534 . . . . 0.0 109.888 176.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 423' ' ' MET . . . . . 0.546 ' HE2' ' HB1' ' A' ' 428' ' ' ALA . 49.9 mtp -150.77 167.68 26.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.335 1.054 . . . . 0.0 109.389 -169.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.76 122.38 17.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 170.214 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -72.34 -33.21 67.12 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -167.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.45 -89.57 0.01 OUTLIER Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.56 -25.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.546 ' HB1' ' HE2' ' A' ' 423' ' ' MET . . . -89.52 -35.15 16.1 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.99 -174.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 81.6 t -85.94 -26.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.345 0.401 0 C-N-CA 118.217 -1.393 . . . . 0.0 109.025 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -68.42 -50.06 55.51 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -66.91 -33.18 75.02 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 120.266 -0.574 . . . . 0.0 112.262 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.23 -36.72 82.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.841 0.746 . . . . 0.0 110.2 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.1 mt -79.21 -8.1 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.55 0.74 . . . . 0.0 111.184 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.7 m -100.08 -21.26 15.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -124.53 -27.77 3.68 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 -169.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.7 mt -134.52 -10.63 2.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.483 1.492 . . . . 0.0 114.711 -173.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.647 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -71.86 100.77 2.48 Favored 'General case' 0 C--O 1.204 -1.335 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -169.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.4 m-80 76.73 22.16 1.17 Allowed 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 123.381 2.81 . . . . 0.0 112.811 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.52 161.3 18.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 168.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.271 37.6 m-85 -74.47 138.4 43.2 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.0 ttt -157.11 142.53 17.37 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.386 0.674 . . . . 0.0 109.603 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 59.34 17.55 5.95 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.42 85.31 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -173.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -133.32 -159.35 0.96 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.773 1.629 . . . . 0.0 108.598 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -128.62 151.02 49.96 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.551 0.341 . . . . 0.0 110.779 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -129.25 82.58 2.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -58.69 127.4 31.99 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 115.98 -1.962 . . . . 0.0 113.343 -172.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.647 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.409 2.1 t -129.94 150.93 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 113.593 -3.243 . . . . 0.0 115.953 168.699 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.3 t -161.49 167.7 25.02 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.585 1.154 . . . . 0.0 109.27 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -72.31 150.86 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 41.6 t -90.71 166.56 13.07 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.334 0.653 . . . . 0.0 111.492 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -106.13 -6.42 18.61 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.621 0.368 . . . . 0.0 110.455 175.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -77.74 152.03 80.13 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 123.98 0.912 . . . . 0.0 111.613 -178.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.52 -38.89 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 123.14 2.56 . . . . 0.0 112.045 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.55 159.38 10.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.608 0.763 . . . . 0.0 110.479 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 64.9 mt -80.51 128.87 38.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 24.8 mmm -94.78 140.61 22.62 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.361 0.265 . . . . 0.0 111.292 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -73.38 158.18 48.59 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 123.318 2.679 . . . . 0.0 109.065 172.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 160.33 -133.95 3.45 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.694 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -72.31 167.8 19.69 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.441 0.696 . . . . 0.0 111.419 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.7 p -154.83 167.78 29.09 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.738 0.815 . . . . 0.0 109.785 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.78 -1.61 0.98 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.62 -171.14 54.41 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.5 mt -142.26 159.96 41.19 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.138 0.975 . . . . 0.0 109.229 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.55 -19.34 62.9 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -120.44 25.5 9.76 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -160.66 -159.15 9.71 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.7 t -133.0 -15.95 2.56 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 80.1 m -127.04 143.69 51.22 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.595 0.358 . . . . 0.0 111.441 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 71.9 p -93.84 3.47 55.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.348 0.659 . . . . 0.0 110.894 175.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -142.74 149.57 38.92 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.115 1.366 . . . . 0.0 114.254 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -154.61 152.88 30.53 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 117.994 0.361 . . . . 0.0 111.454 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -124.24 128.88 49.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.203 1.401 . . . . 0.0 112.45 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.282 3.3 m-85 -91.22 -6.64 53.07 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -177.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.7 t -75.09 -33.52 61.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -81.22 -17.07 50.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.575 0.35 . . . . 0.0 110.468 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 54.7 m -91.31 -3.81 56.47 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 60.91 -1.93 0.22 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.755 1.222 . . . . 0.0 113.204 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -64.73 -22.36 66.96 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.097 0.559 . . . . 0.0 112.064 -176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -59.42 115.6 3.38 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -81.02 -24.14 38.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.331 -0.395 . . . . 0.0 112.015 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.301 62.5 m-85 -97.94 17.44 18.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -64.1 -20.05 65.69 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.04 154.1 70.03 Favored Pre-proline 0 C--O 1.232 0.156 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 177.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -64.1 -23.49 67.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.087 2.525 . . . . 0.0 111.679 177.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -75.76 -29.46 58.82 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.331 -0.231 . . . . 0.0 110.675 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -82.0 -38.95 24.3 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.56 -19.67 65.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.667 0.387 . . . . 0.0 111.81 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.82 -16.73 54.91 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.0 0.37 8.52 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -65.33 157.25 29.66 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.289 178.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.71 118.28 10.96 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.93 41.85 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.437 0.695 . . . . 0.0 111.042 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -64.68 167.92 6.73 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.904 -0.498 . . . . 0.0 110.092 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -57.6 151.12 42.23 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 122.693 0.397 . . . . 0.0 110.777 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.12 162.27 36.42 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 123.479 2.786 . . . . 0.0 110.838 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 33.2 t -158.05 -176.86 6.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -83.68 -3.72 57.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -88.13 146.42 6.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 123.621 0.768 . . . . 0.0 112.572 175.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 8.8 tp -137.38 152.23 49.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.027 0.531 . . . . 0.0 109.833 -178.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -123.9 147.75 47.41 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.838 0.855 . . . . 0.0 109.131 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -142.29 161.53 37.79 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.689 0.757 . . . . 0.0 109.983 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -153.7 166.12 33.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 58.25 57.44 3.95 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.646 0.378 . . . . 0.0 111.434 -174.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -124.86 154.9 70.86 Favored Pre-proline 0 CA--C 1.533 0.299 0 C-N-CA 123.629 0.772 . . . . 0.0 109.935 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.41 156.74 64.91 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.202 1.935 . . . . 0.0 110.305 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.42 -16.53 63.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -173.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -115.36 25.14 11.06 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.5 0.72 . . . . 0.0 111.385 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.85 -14.24 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.96 -177.25 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -164.876 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.699 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.53 -39.4 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.096 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.1 mt-10 -59.27 -45.88 90.03 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 116.956 -1.497 . . . . 0.0 114.77 172.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -88.22 -27.18 21.95 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 122.852 2.569 . . . . 0.0 106.865 -174.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -65.77 -36.08 82.52 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.426 -0.909 . . . . 0.0 113.308 175.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -74.08 -44.26 54.68 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -76.59 -25.0 53.47 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.755 -0.778 . . . . 0.0 111.739 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.2 mt -72.22 -40.56 65.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 O-C-N 121.75 -0.594 . . . . 0.0 110.027 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 74.3 m -65.31 -30.24 71.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.23 0.468 . . . . 0.0 111.294 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -66.91 -39.44 87.4 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.915 0.388 . . . . 0.0 112.026 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -73.42 -6.75 48.29 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.04 -3.73 12.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.865 0.466 . . . . 0.0 111.778 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.88 -16.71 3.15 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.995 0.807 . . . . 0.0 113.931 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.5 m -77.39 156.8 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 118.461 1.13 . . . . 0.0 108.771 177.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -70.83 150.33 45.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.087 0.47 . . . . 0.0 111.496 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -76.19 157.41 83.1 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.311 0.644 . . . . 0.0 110.065 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.41 151.09 83.93 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 122.959 2.44 . . . . 0.0 110.549 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.0 t -83.53 -22.98 32.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -148.67 150.61 33.51 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.282 0.633 . . . . 0.0 110.665 178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.8 m -144.52 156.1 14.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 C-N-CA 123.655 0.782 . . . . 0.0 112.676 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -154.71 144.67 21.74 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.529 0.732 . . . . 0.0 109.505 175.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.96 152.48 28.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -155.51 -177.75 6.78 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.994 1.849 . . . . 0.0 115.994 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.1 p -143.49 -170.34 3.27 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.211 1.004 . . . . 0.0 109.846 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.56 -9.22 62.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.758 0.694 . . . . 0.0 112.254 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -94.43 -26.91 16.3 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 117.54 0.67 . . . . 0.0 111.648 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.4 t -164.59 156.94 16.44 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.235 0.614 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.99 -8.03 31.54 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.842 0.457 . . . . 0.0 110.787 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.26 -33.64 37.7 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 28.0 t -164.94 157.43 16.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.63 0.252 . . . . 0.0 111.651 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 95.3 p -82.9 176.24 9.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.454 0.702 . . . . 0.0 111.051 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.0 t -149.05 162.71 39.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.095 0.958 . . . . 0.0 108.445 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.31 -174.45 47.0 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.124 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.52 160.18 23.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.598 0.759 . . . . 0.0 110.394 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.5 mt -139.77 161.33 37.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.113 1.365 . . . . 0.0 108.347 178.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -151.38 148.39 28.07 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.248 -0.282 . . . . 0.0 111.573 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 22.2 m-90 -129.07 173.67 10.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.877 1.271 . . . . 0.0 111.915 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -7.99 54.74 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 46.8 t -162.03 165.06 27.83 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.193 -0.317 . . . . 0.0 111.295 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.92 -37.62 86.54 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 122.968 0.507 . . . . 0.0 110.269 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.2 p -72.26 -27.26 62.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -71.8 -39.75 69.67 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 175.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.6 -27.14 60.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 62.4 tp -77.89 -40.35 40.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -178.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -70.96 -36.76 72.69 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.65 -23.78 59.91 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 556' ' ' LEU . . . . . 0.576 HD12 HG22 ' A' ' 399' ' ' VAL . 0.9 OUTLIER -67.85 -44.57 76.83 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.113 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -61.55 -37.16 93.72 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-O 119.668 -0.518 . . . . 0.0 112.113 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.292 25.2 m-85 -84.95 -13.33 51.05 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.9 mt -110.81 -10.15 14.45 Favored 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -72.62 144.19 47.91 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.274 0.943 . . . . 0.0 108.829 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 58.77 18.96 6.44 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.952 0.901 . . . . 0.0 112.852 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.45 131.78 51.29 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -77.38 124.83 28.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 121.866 -0.522 . . . . 0.0 110.747 -177.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.0 mtm -83.54 152.57 24.82 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.287 0.235 . . . . 0.0 111.406 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.483 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.6 p90 . . . . . 0 C--O 1.231 0.124 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.99 167.41 27.12 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.889 3.059 . . . . 0.0 111.266 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -129.87 142.44 50.67 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 103.177 -2.897 . . . . 0.0 103.177 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.271 0.7 OUTLIER -81.63 141.14 33.95 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -178.018 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.8 tt -86.46 152.52 22.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.954 1.302 . . . . 0.0 109.455 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.0 pttp -140.44 153.53 46.32 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.159 0.436 . . . . 0.0 110.697 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.46 161.71 38.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.191 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.5 p -161.6 171.52 17.89 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.971 0.909 . . . . 0.0 110.908 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -55.67 125.33 20.67 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 31.2 t -81.65 150.16 28.19 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -171.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -113.72 9.3 17.71 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.91 163.15 20.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.831 0.852 . . . . 0.0 111.542 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -89.41 -7.27 55.51 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.347 0.659 . . . . 0.0 111.776 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -172.49 172.21 4.41 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.668 0.787 . . . . 0.0 110.273 176.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -140.92 20.31 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.243 0.617 . . . . 0.0 111.793 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.2 t . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.691 -1.147 . . . . 0.0 110.499 179.878 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo . . . . . 0 N--CA 1.454 -0.849 0 CA-C-O 120.6 0.167 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -157.72 153.52 26.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.801 0.44 . . . . 0.0 110.701 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -77.8 157.78 29.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.468 0.307 . . . . 0.0 110.3 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 8.6 p30 -84.02 6.57 21.56 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 115.886 1.809 . . . . 0.0 115.886 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 29.8 t -153.72 143.98 15.62 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 119.387 -0.339 . . . . 0.0 111.105 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.5 Cg_exo -62.22 -3.03 3.56 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.387 3.391 . . . . 0.0 113.455 176.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.06 151.01 28.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -122.37 153.54 38.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.526 1.531 . . . . 0.0 108.291 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.7 tpt -135.13 128.41 32.08 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 117.773 0.26 . . . . 0.0 110.64 -176.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -122.4 153.23 26.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -175.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -142.98 175.91 9.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.365 -2.458 . . . . 0.0 104.365 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.64 15.91 67.17 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 37.7 mt -86.46 19.6 2.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.389 0.675 . . . . 0.0 111.557 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.321 8.4 p30 -73.48 32.29 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 117.285 2.328 . . . . 0.0 117.285 -173.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -140.55 154.54 46.57 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 110.29 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 86.8 p -66.05 -11.45 48.44 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -78.63 -9.49 59.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.203 0.456 . . . . 0.0 111.635 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 60.1 mmm -97.32 149.75 21.74 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 117.936 0.334 . . . . 0.0 110.224 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -161.55 154.86 21.2 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 22.3 p -59.18 -35.8 74.19 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.16 -38.71 78.89 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -74.4 -51.33 15.3 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.98 -33.9 63.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.211 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.427 ' HA ' ' CE1' ' A' ' 400' ' ' PHE . 5.5 t80 -75.66 -30.64 59.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.584 -174.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -74.83 -32.46 61.95 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.443 1.019 . . . . 0.0 110.068 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 399' ' ' VAL . . . . . 0.431 HG22 ' CD2' ' A' ' 556' ' ' LEU . 30.0 t -57.52 -57.7 9.13 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 400' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 397' ' ' PHE 0.49 2.6 p90 -76.54 -5.08 46.08 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 117.646 2.462 . . . . 0.0 117.646 174.556 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.456 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.5 t -74.32 -34.54 63.48 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 118.198 0.453 . . . . 0.0 111.133 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 402' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' A' ' 403' ' ' TYR . 3.0 pp -61.41 -16.46 46.9 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.959 177.117 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 403' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 402' ' ' LEU 0.252 55.2 m-85 -85.08 -5.28 59.35 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 118.298 2.703 . . . . 0.0 118.298 -179.556 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.91 -167.07 39.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.475 -0.869 . . . . 0.0 113.303 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -84.95 120.06 26.07 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.683 0.793 . . . . 0.0 109.361 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.456 HG11 ' HA ' ' A' ' 401' ' ' CYS . 1.4 m -113.94 165.49 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.053 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -174.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -133.36 -57.36 0.9 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -149.79 164.28 35.72 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.44 147.01 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 124.625 1.17 . . . . 0.0 109.073 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.4 130.36 11.0 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.335 0.254 . . . . 0.0 111.64 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.3 m-85 -85.0 156.08 21.29 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.9 mmt -95.75 118.02 31.63 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.534 0.733 . . . . 0.0 112.244 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -79.11 -14.35 59.18 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.914 0.485 . . . . 0.0 111.124 172.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.7 p -90.26 1.47 56.47 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.625 0.77 . . . . 0.0 111.875 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -136.06 155.21 77.76 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 123.664 0.786 . . . . 0.0 110.46 -176.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.76 -15.67 33.37 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.249 2.633 . . . . 0.0 111.624 178.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.78 95.21 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.14 159.42 36.16 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.879 0.872 . . . . 0.0 109.281 177.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.56 156.64 21.1 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 71.8 mtm -102.58 154.73 18.84 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.427 0.691 . . . . 0.0 109.997 172.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.05 124.93 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 123.314 0.646 . . . . 0.0 110.893 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -103.62 127.84 51.0 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtm -154.63 172.4 17.92 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.796 0.838 . . . . 0.0 109.85 -174.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.79 122.07 16.04 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -72.35 -33.47 67.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.79 -87.97 0.01 OUTLIER Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -73.01 -26.81 61.46 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 117.185 2.291 . . . . 0.0 117.185 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.8 -37.19 19.52 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.052 -1.059 . . . . 0.0 111.798 -174.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.0 t -85.87 -26.22 6.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.622 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -66.42 -51.91 52.0 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.164 -0.335 . . . . 0.0 111.391 175.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -69.93 -31.15 68.77 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.38 72.66 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.915 0.78 . . . . 0.0 110.089 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -78.11 -15.48 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 123.222 0.609 . . . . 0.0 110.752 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.4 m -93.01 -18.88 22.15 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.458 ' C ' HD22 ' A' ' 436' ' ' LEU . 95.7 m-70 -129.77 -21.37 3.08 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -170.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.5 mm? -134.71 -12.34 2.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.956 1.707 . . . . 0.0 114.311 -174.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.6 p-10 -71.73 100.92 2.45 Favored 'General case' 0 C--O 1.205 -1.237 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -168.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.58 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 15.0 m-80 77.04 21.51 1.11 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 123.159 2.709 . . . . 0.0 113.771 -161.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -78.84 161.32 26.85 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.94 -1.1 . . . . 0.0 111.155 168.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 440' ' ' PHE . . . . . 0.418 ' CZ ' ' HE3' ' A' ' 445' ' ' LYS . 55.7 m-85 -71.3 142.42 50.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.2 ttt -162.5 134.52 5.42 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.392 50.8 m-85 55.98 27.32 11.06 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 83.72 8.78 84.02 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -132.5 178.33 6.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.315 1.046 . . . . 0.0 109.266 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 445' ' ' LYS . . . . . 0.418 ' HE3' ' CZ ' ' A' ' 440' ' ' PHE . 40.1 ttmt -125.19 133.75 52.64 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 111.033 178.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 63.0 mtm -80.63 -158.18 0.18 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.404 1.082 . . . . 0.0 109.046 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.58 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 37.1 t-20 -162.59 123.26 2.46 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 115.631 -2.128 . . . . 0.0 108.599 168.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.45 2.2 t -125.86 151.42 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 112.337 -3.745 . . . . 0.0 116.556 170.371 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 26.1 t -161.38 174.94 12.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.714 1.606 . . . . 0.0 107.938 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.2 p -73.95 149.36 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.3 t -84.21 158.45 21.29 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.882 0.473 . . . . 0.0 110.973 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -104.45 -1.81 26.21 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.459 -0.151 . . . . 0.0 110.692 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -86.79 146.47 41.18 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 123.176 0.59 . . . . 0.0 110.066 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.57 -31.14 4.49 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.319 2.68 . . . . 0.0 112.493 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.47 161.28 13.81 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.022 0.529 . . . . 0.0 110.382 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 79.0 mt -87.76 136.54 22.9 Favored 'Isoleucine or valine' 0 C--O 1.23 0.062 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 59.8 mmm -101.39 130.16 25.38 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.458 0.303 . . . . 0.0 110.913 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.54 171.42 18.07 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.608 2.872 . . . . 0.0 110.402 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 131.41 -125.41 4.4 Favored Glycine 0 C--N 1.336 0.551 0 N-CA-C 111.424 -0.67 . . . . 0.0 111.424 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -72.47 164.91 25.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.361 0.6 . . . . 0.0 112.21 -176.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 97.0 p -158.4 -179.16 7.84 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.154 0.981 . . . . 0.0 109.529 -177.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -140.88 161.96 36.58 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -80.65 131.69 10.67 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.4 mt -80.0 166.81 21.2 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.07 -22.57 64.0 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.248 -0.282 . . . . 0.0 111.178 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -120.52 25.83 9.54 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.154 0.582 . . . . 0.0 110.242 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.36 -163.07 14.33 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 121.859 -0.526 . . . . 0.0 112.419 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 48.4 t -133.09 -16.69 2.46 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.061 0.544 . . . . 0.0 111.551 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.5 t -127.09 145.98 50.54 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.957 0.503 . . . . 0.0 110.059 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 89.8 p -97.47 9.51 42.19 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.403 0.681 . . . . 0.0 111.628 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -136.15 147.24 47.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -157.84 154.15 27.55 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.606 0.362 . . . . 0.0 110.188 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 2.4 t0 -131.85 130.3 41.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -93.63 -8.89 39.8 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 117.252 2.315 . . . . 0.0 117.252 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 48.3 t -87.19 -32.27 19.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -79.25 3.8 16.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.568 0.747 . . . . 0.0 111.711 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 77.4 p -134.21 9.01 3.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.292 0.637 . . . . 0.0 111.767 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 62.77 -0.86 0.52 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.845 1.258 . . . . 0.0 113.986 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -59.21 -26.6 64.98 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.698 -0.626 . . . . 0.0 111.864 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -56.32 124.21 17.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.167 0.987 . . . . 0.0 109.994 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -81.02 -32.14 34.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -172.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.306 63.2 m-85 -97.92 17.1 18.99 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -69.12 -14.31 62.92 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -173.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.58 151.75 71.53 Favored Pre-proline 0 C--O 1.232 0.139 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 33.5 Cg_exo -65.0 -23.83 60.88 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 123.02 2.48 . . . . 0.0 111.426 176.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -75.71 -29.7 59.05 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.359 0.263 . . . . 0.0 110.452 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -82.4 -41.98 19.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 174.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.83 64.81 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -80.79 -19.04 45.66 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -4.5 7.96 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -63.67 157.14 24.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.276 0.489 . . . . 0.0 110.414 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -150.44 144.83 25.66 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.4 mm -137.65 148.05 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 123.331 0.652 . . . . 0.0 110.225 -171.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -150.51 169.04 22.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.108 0.963 . . . . 0.0 110.186 178.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -62.88 155.92 69.02 Favored Pre-proline 0 N--CA 1.455 -0.213 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -62.21 145.49 96.19 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 122.521 2.147 . . . . 0.0 109.561 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.2 t -153.98 173.99 15.25 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.978 0.511 . . . . 0.0 109.653 -174.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.71 -3.06 57.47 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.268 -0.27 . . . . 0.0 110.935 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -98.38 135.86 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.437 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 64.8 mt -125.41 152.14 45.25 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.372 0.669 . . . . 0.0 109.717 174.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -110.51 143.59 40.64 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 173.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -131.28 157.77 42.42 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.224 0.535 . . . . 0.0 111.647 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -152.19 167.68 27.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 103.847 -2.649 . . . . 0.0 103.847 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 54.39 31.87 15.39 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -93.57 156.21 39.93 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 117.685 0.22 . . . . 0.0 110.864 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.73 151.14 57.65 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 123.326 2.684 . . . . 0.0 111.754 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.46 -16.58 63.95 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.315 0.646 . . . . 0.0 112.412 -177.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -122.67 26.42 8.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.579 0.752 . . . . 0.0 111.005 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.57 -14.22 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.3 OUTLIER -54.74 -177.39 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -165.496 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.705 ' H ' HG22 ' A' ' 510' ' ' THR . 84.6 tt0 -10.33 -53.74 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.176 1.79 . . . . 0.0 114.919 -174.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.5 mt-10 -61.4 -41.18 96.72 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -89.35 -27.33 20.56 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 123.262 2.755 . . . . 0.0 106.398 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -61.71 -39.96 93.37 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.875 -1.13 . . . . 0.0 113.09 174.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -70.47 -45.95 64.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -77.88 -24.95 48.33 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 119.918 -0.713 . . . . 0.0 111.468 -177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 53.2 mt -70.53 -39.14 75.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 118.867 0.758 . . . . 0.0 109.417 176.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 85.6 m -65.66 -32.8 74.56 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.98 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -70.16 -27.18 64.33 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -80.02 -9.19 59.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.273 0.229 . . . . 0.0 111.577 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.26 -5.95 14.61 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.096 0.558 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.55 -10.06 13.48 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 123.715 0.674 . . . . 0.0 113.025 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.9 m -79.82 159.03 4.46 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.102 0 CA-C-N 118.131 0.966 . . . . 0.0 112.45 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -67.59 148.44 51.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 121.179 0.514 . . . . 0.0 111.376 -176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -81.6 158.07 68.97 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.602 0.761 . . . . 0.0 110.884 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.24 170.88 12.41 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 123.864 3.043 . . . . 0.0 110.43 172.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -119.21 -17.97 8.77 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 64.5 m -147.49 146.84 29.65 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 123.187 0.595 . . . . 0.0 109.884 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.24 156.94 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -175.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -150.34 141.05 22.66 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -138.53 142.17 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -154.06 -172.79 4.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 22.8 t -136.84 -174.29 3.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.625 0.77 . . . . 0.0 110.11 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.88 -15.53 62.53 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.04 0.828 . . . . 0.0 111.758 -178.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 50.4 mmtm -88.46 -28.32 20.93 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.453 0.627 . . . . 0.0 110.742 175.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.9 t -166.31 158.93 14.4 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.76 . . . . 0.0 109.963 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -117.05 -4.19 11.5 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.441 0.696 . . . . 0.0 109.855 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -24.26 21.55 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.654 0.782 . . . . 0.0 110.637 -179.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 13.0 m -158.71 167.17 30.22 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.763 0.825 . . . . 0.0 111.073 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 46.9 t -79.61 164.13 24.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.64 0.776 . . . . 0.0 111.569 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 39.6 t -151.95 150.42 30.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.479 1.111 . . . . 0.0 109.376 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 170.56 -173.6 44.43 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.815 -178.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -112.05 157.66 20.5 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 123.318 0.647 . . . . 0.0 110.17 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 28.2 tp -146.32 151.74 38.01 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -147.04 149.25 32.73 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 546' ' ' TRP . . . . . 0.437 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 17.7 m-90 -121.38 172.0 8.36 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.491 1.516 . . . . 0.0 112.536 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -74.99 -11.07 60.03 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.612 0.365 . . . . 0.0 111.137 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -156.72 158.96 37.86 Favored 'General case' 0 C--O 1.232 0.135 0 O-C-N 121.629 -0.669 . . . . 0.0 111.375 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.5 -26.25 62.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.537 0.335 . . . . 0.0 110.851 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.1 p -78.64 -25.53 45.01 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.75 -35.36 70.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 175.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.4 -28.55 59.48 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.755 -0.202 . . . . 0.0 110.665 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 39.6 tp -72.79 -44.02 62.06 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 117.875 0.307 . . . . 0.0 111.131 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -72.72 -39.48 66.89 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.904 -0.498 . . . . 0.0 109.947 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.47 -26.92 65.73 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 556' ' ' LEU . . . . . 0.431 ' CD2' HG22 ' A' ' 399' ' ' VAL . 5.7 tt -68.23 -32.39 72.56 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 172.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.39 -41.48 99.76 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.265 10.5 m-85 -89.05 -18.79 26.59 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.743 2.868 . . . . 0.0 118.743 178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.81 -16.68 15.33 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.754 0.706 . . . . 0.0 112.323 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -73.82 143.81 45.78 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 119.317 0.962 . . . . 0.0 108.846 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.85 18.45 2.99 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.516 1.126 . . . . 0.0 112.966 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.264 43.8 t80 -72.88 138.55 46.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -73.86 134.03 43.24 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.131 -0.356 . . . . 0.0 111.813 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.6 mtm -84.58 152.6 23.75 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 122.679 0.392 . . . . 0.0 111.663 176.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.168 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 170.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.7 p90 . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -74.59 163.51 35.79 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.663 2.909 . . . . 0.0 111.238 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -129.91 142.33 50.67 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 174.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.7 OUTLIER -81.94 138.7 34.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -177.559 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.8 tt -79.67 152.29 30.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.64 153.5 46.05 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.902 0.319 . . . . 0.0 110.665 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.33 166.33 33.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.784 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 43.1 t -155.92 160.03 39.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.91 0.884 . . . . 0.0 109.761 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -57.37 119.2 6.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.9 t -76.14 148.15 38.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -169.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.8 t -114.14 11.77 17.66 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 169.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.6 163.04 22.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.887 0.875 . . . . 0.0 111.942 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -93.53 -3.14 53.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.742 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -153.33 170.56 20.34 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.539 0.736 . . . . 0.0 110.752 -177.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.34 23.49 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.051 0.94 . . . . 0.0 109.873 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.369 -1.3 . . . . 0.0 110.61 -176.116 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.455 -0.776 0 N-CA-C 111.08 -0.392 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -156.01 156.51 34.56 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.796 0.439 . . . . 0.0 110.564 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.05 160.68 30.94 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.879 0.472 . . . . 0.0 111.034 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -73.78 -7.34 51.76 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 28.7 t -159.92 148.37 13.55 Favored Pre-proline 0 C--O 1.232 0.144 0 C-N-CA 122.924 0.489 . . . . 0.0 110.547 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.55 -16.01 46.19 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.26 2.64 . . . . 0.0 110.557 174.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -85.37 150.55 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.44 156.3 46.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.65 1.18 . . . . 0.0 108.563 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 45.6 tpp -137.48 135.72 37.08 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.208 -0.308 . . . . 0.0 111.082 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.17 152.0 34.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -176.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -138.78 177.9 7.55 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 9.89 82.2 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.896 -0.391 . . . . 0.0 112.255 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 44.4 mt -78.27 28.03 0.19 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.473 0.709 . . . . 0.0 111.851 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -64.89 -27.55 68.93 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -175.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.49 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.5 pm0 -79.16 150.91 31.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.006 0.431 . . . . 0.0 111.208 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.7 m -70.72 -5.83 32.77 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.02 -15.32 61.52 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 118.093 0.406 . . . . 0.0 111.921 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 71.3 mmm -95.13 147.08 23.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.196 0.453 . . . . 0.0 111.382 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -158.73 163.52 36.72 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.357 1.063 . . . . 0.0 108.508 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 86.8 m -54.28 -44.62 72.04 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.061 0.391 . . . . 0.0 110.857 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -68.01 -37.28 81.24 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -74.08 -48.39 30.07 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.09 -39.62 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 6.9 t80 -75.91 -31.91 59.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -71.05 -38.45 72.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.159 0.436 . . . . 0.0 110.198 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -61.82 -48.32 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 120.102 -0.639 . . . . 0.0 112.608 -176.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.523 2.5 p90 -76.6 -12.07 59.96 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 168.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.3 t -66.86 -24.79 66.18 Favored 'General case' 0 C--N 1.338 0.071 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 402' ' ' LEU . . . . . 0.436 HD21 ' HB3' ' A' ' 578' ' ' CYS . 0.5 OUTLIER -49.52 -37.16 25.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.242 0.617 . . . . 0.0 110.926 173.065 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -79.51 -14.86 58.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -176.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.16 -174.6 45.99 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 118.939 0.791 . . . . 0.0 112.946 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -73.54 124.88 26.73 Favored 'General case' 0 C--O 1.231 0.109 0 O-C-N 122.644 -0.327 . . . . 0.0 111.754 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.443 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.4 m -114.09 165.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.096 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 178.084 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -126.42 -59.51 1.3 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -146.58 166.18 27.27 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 118.852 0.751 . . . . 0.0 112.98 -173.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.28 148.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 124.472 1.109 . . . . 0.0 109.332 175.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -157.3 126.19 5.81 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.116 0.566 . . . . 0.0 111.042 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.92 153.87 38.41 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 36.4 mmt -86.62 117.03 25.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.308 0.643 . . . . 0.0 110.317 175.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -79.21 -15.77 57.55 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.425 -0.172 . . . . 0.0 111.4 171.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 32.5 t -90.15 -5.88 55.98 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -124.34 154.81 69.1 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 123.351 0.66 . . . . 0.0 109.836 -176.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.26 -17.06 40.03 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.412 2.741 . . . . 0.0 111.86 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.08 94.75 0.09 OUTLIER Glycine 0 C--N 1.336 0.536 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.41 163.01 35.84 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.537 0.735 . . . . 0.0 109.462 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.39 143.04 13.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 84.7 mtp -82.59 151.68 26.27 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.8 t -146.53 153.79 12.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 422' ' ' GLU . . . . . 0.413 ' C ' ' HG3' ' A' ' 423' ' ' MET . 79.8 tt0 -135.22 133.42 39.0 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.102 -0.374 . . . . 0.0 110.002 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 423' ' ' MET . . . . . 0.413 ' HG3' ' C ' ' A' ' 422' ' ' GLU . 60.4 mtp -150.59 169.35 21.77 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.197 0.999 . . . . 0.0 109.461 -171.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.465 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.9 123.04 18.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 171.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.2 p30 -72.29 -33.55 67.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 -166.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.37 -89.62 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.33 -25.47 60.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.72 -32.68 16.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 118.735 -1.186 . . . . 0.0 112.208 -174.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.68 -24.31 6.09 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 C-N-CA 118.04 -1.464 . . . . 0.0 109.031 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -69.34 -47.78 63.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.785 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -63.7 -40.25 96.31 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.06 -36.72 85.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.464 0.574 . . . . 0.0 110.589 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.8 mt -81.73 -10.16 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 123.066 0.547 . . . . 0.0 111.706 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 52.8 m -102.26 -16.56 16.27 Favored 'General case' 0 N--CA 1.461 0.082 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -135.42 -19.74 1.65 Allowed 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -170.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 8.9 tp -134.57 -15.34 2.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -170.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 17.8 p-10 -71.38 101.0 2.28 Favored 'General case' 0 C--O 1.204 -1.31 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -169.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.7 m-80 78.2 21.98 0.82 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 123.988 3.085 . . . . 0.0 113.889 -161.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -76.05 159.76 30.48 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.331 -0.855 . . . . 0.0 110.713 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -78.12 138.78 38.9 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 174.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.8 ttt -159.23 135.81 9.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.793 0.437 . . . . 0.0 109.919 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.329 51.9 m-85 58.07 21.56 8.01 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.79 7.24 88.37 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -124.18 -167.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.365 1.466 . . . . 0.0 108.459 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -138.4 151.19 47.25 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.546 0.338 . . . . 0.0 110.534 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -130.42 87.66 2.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -56.26 129.47 40.42 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 115.541 -2.171 . . . . 0.0 111.594 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.447 1.9 t -125.88 149.45 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 113.531 -3.268 . . . . 0.0 116.353 168.947 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 42.0 t -159.54 165.97 31.81 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.778 1.231 . . . . 0.0 108.166 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -71.38 148.63 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 22.2 t -85.34 161.98 19.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.017 0.527 . . . . 0.0 110.851 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -106.74 -0.23 23.7 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 117.515 0.143 . . . . 0.0 110.914 177.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -82.01 151.55 67.15 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.53 0.732 . . . . 0.0 110.317 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -77.43 -35.88 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.257 2.638 . . . . 0.0 112.208 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.76 158.84 9.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.352 0.661 . . . . 0.0 110.583 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.4 mt -79.96 146.71 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 81.9 mtp -119.25 130.14 25.01 Favored Pre-proline 0 N--CA 1.454 -0.253 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.87 163.81 34.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.632 2.888 . . . . 0.0 110.122 176.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.03 -125.04 1.71 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -72.43 166.62 22.21 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.948 0.499 . . . . 0.0 111.239 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 34.3 t -157.81 165.73 34.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.615 0.766 . . . . 0.0 109.773 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -125.62 -1.61 7.39 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.79 -178.8 51.83 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.005 0.336 . . . . 0.0 112.488 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 90.5 mt -143.77 160.53 40.56 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.964 0.906 . . . . 0.0 109.769 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.51 -12.0 61.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.752 0.421 . . . . 0.0 111.647 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -120.48 20.74 11.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.175 0.59 . . . . 0.0 110.29 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -169.77 -153.37 8.52 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.2 m -132.92 -15.44 2.63 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.2 t -127.06 146.25 50.43 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.753 0.421 . . . . 0.0 110.117 176.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.7 p -93.82 10.5 32.88 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.415 0.686 . . . . 0.0 110.874 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -135.61 147.92 48.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -156.77 154.24 29.63 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-O 120.704 0.288 . . . . 0.0 110.375 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 0.4 OUTLIER -132.63 140.19 48.09 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.888 0.875 . . . . 0.0 113.148 179.46 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.291 15.8 m-85 -111.03 8.61 21.96 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 117.638 2.458 . . . . 0.0 117.638 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.2 t -71.67 -28.68 63.9 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -92.5 -18.66 22.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.919 0.888 . . . . 0.0 111.289 178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 75.0 m -76.59 -17.78 59.01 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.93 2.24 0.97 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.66 1.184 . . . . 0.0 114.103 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -62.74 -15.4 53.05 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.462 -0.774 . . . . 0.0 112.862 -178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.21 124.62 17.58 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.81 0.444 . . . . 0.0 110.976 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -72.81 -33.52 66.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.62 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.328 57.9 m-85 -98.02 17.27 18.75 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.2 t -61.76 -22.11 65.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.413 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -136.48 152.05 74.1 Favored Pre-proline 0 C--N 1.339 0.134 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -178.073 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 31.3 Cg_exo -63.68 -31.73 69.25 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.249 2.632 . . . . 0.0 112.43 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -78.86 -21.74 47.08 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 117.689 0.222 . . . . 0.0 111.091 -178.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -80.66 -41.95 22.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.84 -20.02 64.66 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.633 0.373 . . . . 0.0 111.912 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.42 -20.41 47.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.04 2.59 8.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -61.99 155.76 22.94 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.315 0.507 . . . . 0.0 111.934 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 18.4 mtt180 -141.92 131.57 24.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.5 mm -139.65 145.11 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 123.723 0.809 . . . . 0.0 109.001 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -158.29 159.22 35.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.152 0.581 . . . . 0.0 109.455 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -60.51 158.61 29.06 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -61.35 146.1 97.6 Favored 'Trans proline' 0 N--CA 1.451 -1.026 0 C-N-CA 122.292 1.995 . . . . 0.0 109.946 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -153.7 171.47 18.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -175.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -83.65 -7.88 59.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 1.9 t -85.46 141.92 13.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 174.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 11.7 tp -139.9 150.94 45.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.515 0.326 . . . . 0.0 110.209 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -125.01 150.06 47.1 Favored 'General case' 0 C--N 1.334 -0.106 0 C-N-CA 124.05 0.94 . . . . 0.0 108.848 -177.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -139.63 159.26 42.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.294 0.568 . . . . 0.0 111.952 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -150.42 166.34 30.39 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 54.42 57.16 6.06 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.341 0.257 . . . . 0.0 111.215 -175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -129.34 150.61 76.02 Favored Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 122.455 0.302 . . . . 0.0 110.929 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.421 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 52.2 Cg_exo -55.96 156.51 19.5 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.703 2.936 . . . . 0.0 113.014 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.27 -16.68 64.05 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.461 0.704 . . . . 0.0 111.058 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -122.67 24.3 9.2 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.89 0.876 . . . . 0.0 110.831 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.0 p -63.3 -13.16 12.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -55.37 -177.6 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 117.977 -1.011 . . . . 0.0 113.556 -165.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.672 ' H ' HG22 ' A' ' 510' ' ' THR . 22.8 pt-20 -21.29 -41.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -170.138 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.3 mt-10 -56.1 -48.75 75.54 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 117.413 -1.28 . . . . 0.0 114.413 172.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -87.07 -26.07 23.87 Favored 'General case' 0 C--N 1.35 0.61 0 CA-C-N 122.474 2.397 . . . . 0.0 106.886 -173.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -66.98 -38.22 85.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -73.39 -40.27 64.46 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -76.07 -22.82 55.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.483 -177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 55.8 mt -77.08 -45.31 30.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-N 118.417 0.553 . . . . 0.0 110.924 178.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 28.4 p -71.81 -27.58 63.02 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.599 -178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -71.7 -36.77 70.65 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.792 0.33 . . . . 0.0 111.499 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.61 -28.77 66.22 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.388 0.275 . . . . 0.0 111.307 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 91.4 mt -94.85 -5.63 44.59 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.658 0.383 . . . . 0.0 111.569 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.86 1.61 62.84 Favored Glycine 0 CA--C 1.531 1.052 0 CA-C-O 119.584 -0.564 . . . . 0.0 113.119 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.3 m -76.91 163.65 3.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 118.18 0.99 . . . . 0.0 112.941 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.43 144.97 53.22 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -83.43 144.18 45.86 Favored Pre-proline 0 N--CA 1.455 -0.215 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.154 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -70.17 151.61 66.82 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.303 2.668 . . . . 0.0 110.839 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -95.51 -17.61 21.31 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 176.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 27.8 t -152.42 159.79 43.35 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-O 120.597 0.237 . . . . 0.0 111.031 175.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 7.5 p -155.27 150.1 11.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 C-N-CA 123.184 0.593 . . . . 0.0 110.267 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -150.53 144.06 25.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.465 1.106 . . . . 0.0 108.8 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.21 151.94 31.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -156.61 -173.27 4.4 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -178.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 90.8 p -140.42 -177.47 5.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.011 0.924 . . . . 0.0 110.376 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.26 -8.97 62.91 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 123.839 0.733 . . . . 0.0 112.223 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.32 -28.26 21.15 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.95 0.875 . . . . 0.0 111.437 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.5 t -166.4 159.71 14.92 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.26 0.624 . . . . 0.0 110.057 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.08 -7.83 31.79 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.631 0.372 . . . . 0.0 110.296 175.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -79.77 -30.52 40.73 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.8 p -164.91 168.7 17.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.196 0.522 . . . . 0.0 112.057 -173.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 40.6 t -82.82 166.93 18.57 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.756 0.823 . . . . 0.0 110.325 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 62.7 m -142.65 159.23 42.64 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.349 1.06 . . . . 0.0 108.405 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.47 -174.16 46.66 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 119.834 -1.175 . . . . 0.0 113.415 -179.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.24 160.27 22.5 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.691 0.796 . . . . 0.0 110.699 -177.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 87.6 mt -142.03 162.47 35.41 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.572 1.549 . . . . 0.0 108.198 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -152.32 148.69 27.82 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.26 -0.275 . . . . 0.0 110.907 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 10.5 m-90 -126.41 175.27 7.99 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 125.228 1.411 . . . . 0.0 112.624 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -75.59 -9.78 58.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 42.0 t -161.38 158.09 26.31 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 122.852 0.461 . . . . 0.0 110.635 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.0 -21.01 63.26 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.361 0.264 . . . . 0.0 111.13 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.3 p -80.69 -24.83 38.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 117.929 0.331 . . . . 0.0 110.65 177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -76.26 -34.16 59.16 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.16 -26.29 59.01 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 175.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.1 tp -77.41 -35.75 53.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.726 0.41 . . . . 0.0 110.882 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.97 -37.58 75.82 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.9 m -72.77 -30.21 63.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -63.48 -33.83 76.44 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.0 -56.58 17.67 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 14.3 m-85 -82.38 -16.89 47.48 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -175.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.74 -13.95 14.91 Favored 'General case' 0 C--N 1.338 0.08 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -73.68 142.3 46.41 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.894 1.225 . . . . 0.0 108.995 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 60.67 10.55 2.67 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.49 1.116 . . . . 0.0 112.967 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 33.6 t80 -73.48 141.47 46.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -73.02 142.48 47.69 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 564' ' ' MET . . . . . 0.421 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 78.4 mtm -83.58 152.33 24.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.316 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 62.1 pttt . . . . . 0 CA--C 1.53 0.191 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.335 -176.823 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 CA--C 1.529 0.164 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.76 154.51 67.64 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 123.126 2.551 . . . . 0.0 111.704 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -130.01 142.45 50.63 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 102.887 -3.005 . . . . 0.0 102.887 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 145.87 50.85 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 116.064 1.876 . . . . 0.0 116.064 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.4 tt -100.96 153.95 19.09 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.891 1.276 . . . . 0.0 108.378 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.8 155.42 44.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 120.982 0.42 . . . . 0.0 111.042 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.44 162.91 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.57 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 578' ' ' CYS . . . . . 0.436 ' HB3' HD21 ' A' ' 402' ' ' LEU . 17.0 p -159.24 164.86 34.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.473 0.709 . . . . 0.0 111.442 -172.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -56.53 123.51 15.06 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.1 t -77.43 145.65 37.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.268 0.8 OUTLIER -110.86 9.09 22.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 169.802 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.47 164.23 19.25 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.957 0.903 . . . . 0.0 111.112 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -90.75 1.31 56.99 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.939 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -177.41 176.58 1.29 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.531 1.132 . . . . 0.0 109.856 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -138.96 20.05 2.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.967 0.507 . . . . 0.0 111.226 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.248 -179.406 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.453 -0.865 0 N-CA-C 110.847 -0.482 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -149.3 156.87 42.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.988 0.423 . . . . 0.0 110.74 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.58 162.39 29.27 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.901 0.48 . . . . 0.0 111.164 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -72.64 -8.0 53.13 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -178.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -159.64 148.53 14.02 Favored Pre-proline 0 N--CA 1.455 -0.221 0 C-N-CA 122.635 0.374 . . . . 0.0 110.948 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.57 -19.29 44.17 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.697 2.931 . . . . 0.0 111.56 172.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.79 148.56 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.0 tt -132.67 152.83 51.58 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.981 1.313 . . . . 0.0 108.372 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -135.96 132.44 36.39 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -175.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.38 153.6 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -143.85 166.14 25.75 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 104.778 -2.304 . . . . 0.0 104.778 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 91.62 11.3 60.82 Favored Glycine 0 CA--C 1.529 0.914 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 54.3 mt -81.19 35.11 0.38 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.934 0.894 . . . . 0.0 110.91 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.292 8.5 p30 -81.65 25.21 0.54 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -171.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -134.45 157.79 45.56 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 123.042 0.537 . . . . 0.0 110.684 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -69.08 -11.53 60.87 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.65 0.78 . . . . 0.0 112.962 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -80.31 -9.25 59.73 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.5 0.32 . . . . 0.0 111.563 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 61.6 mmm -96.23 144.26 26.59 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 118.021 0.373 . . . . 0.0 110.273 -177.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -159.51 153.22 22.86 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.5 p -58.54 -30.23 66.94 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -72.05 -41.84 66.99 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 177.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 84.6 mtt-85 -75.99 -44.97 37.06 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.731 0.301 . . . . 0.0 111.245 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.29 -41.73 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -174.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -73.63 -41.14 63.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 398' ' ' ASN . . . . . 0.495 ' HA ' ' SG ' ' A' ' 401' ' ' CYS . 3.9 p30 -66.56 -31.13 71.64 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.696 -0.802 . . . . 0.0 109.269 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.84 -60.77 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 107.186 -1.412 . . . . 0.0 107.186 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.481 0.6 OUTLIER -76.61 -20.48 56.7 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 118.936 2.939 . . . . 0.0 118.936 177.765 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 398' ' ' ASN . 2.8 p -81.64 -19.26 42.13 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.07 0.85 . . . . 0.0 111.139 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 402' ' ' LEU . . . . . 0.411 ' C ' HD12 ' A' ' 402' ' ' LEU . 3.5 pp -61.29 -15.2 32.88 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.978 0.808 . . . . 0.0 111.107 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -76.46 -8.12 56.51 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -171.14 -147.57 5.69 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 -175.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -88.22 159.88 17.95 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.712 0.405 . . . . 0.0 110.965 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.469 HG22 ' HB3' ' A' ' 480' ' ' ASN . 1.7 m -114.17 154.07 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -176.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -144.77 -74.66 0.24 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -149.05 167.58 25.48 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 -172.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 4.3 p -154.81 147.28 13.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 124.794 1.237 . . . . 0.0 108.551 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -157.04 133.37 9.81 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -81.39 168.32 18.49 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.942 1.83 . . . . 0.0 115.942 177.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 50.5 mtt -130.89 128.18 40.03 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-O 120.9 0.381 . . . . 0.0 111.6 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 413' ' ' LYS . . . . . 0.4 ' HG3' ' H ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.2 -5.94 55.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.832 0.853 . . . . 0.0 112.341 175.145 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.5 p -83.32 -7.25 59.61 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.331 0.652 . . . . 0.0 112.451 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.08 157.55 77.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 C-N-CA 123.86 0.864 . . . . 0.0 109.422 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.93 -14.25 43.0 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.26 2.64 . . . . 0.0 111.235 177.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.74 98.67 0.11 Allowed Glycine 0 C--N 1.338 0.645 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 175.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.84 158.17 36.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.36 0.664 . . . . 0.0 109.492 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.39 150.85 23.9 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.275 0.559 . . . . 0.0 112.231 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 34.6 ttm -96.57 151.8 19.25 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.559 1.144 . . . . 0.0 108.313 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 37.9 t -144.85 154.28 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -142.42 135.8 28.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 71.7 mtm -160.45 177.58 10.42 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.355 1.462 . . . . 0.0 108.987 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.61 125.5 24.47 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 171.442 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -72.3 -33.57 67.5 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.34 -84.43 0.04 OUTLIER Glycine 0 C--N 1.333 0.413 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -73.52 -29.32 62.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.25 -35.14 18.67 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.431 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.43 -24.96 6.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.311 0 C-N-CA 118.916 -1.114 . . . . 0.0 109.828 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -70.33 -50.37 39.85 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.46 174.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -64.32 -36.05 82.86 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.623 -0.673 . . . . 0.0 112.032 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.63 -34.57 78.53 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.005 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -80.62 -8.04 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.528 0.731 . . . . 0.0 111.141 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 7.1 m -100.37 -18.87 16.56 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 176.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -131.89 -21.34 2.44 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -170.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 86.7 mt -134.43 -14.37 2.25 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.0 p-10 -71.65 100.86 2.39 Favored 'General case' 0 C--O 1.205 -1.285 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -170.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.525 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 22.7 m-80 77.07 21.94 1.06 Allowed 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 124.11 3.141 . . . . 0.0 112.526 -159.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -87.65 154.95 20.19 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 168.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -78.33 140.58 38.78 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -154.87 134.63 12.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.198 0.599 . . . . 0.0 110.272 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.388 48.4 m-85 59.43 19.09 7.44 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.93 10.73 62.46 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 120.017 -0.324 . . . . 0.0 112.446 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -146.14 150.18 35.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 117.411 0.606 . . . . 0.0 110.405 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -84.94 149.69 25.46 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.253 -0.279 . . . . 0.0 110.928 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -131.37 92.43 3.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.983 0.513 . . . . 0.0 109.636 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.525 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 21.5 t-20 -58.51 130.7 48.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 115.877 -2.011 . . . . 0.0 112.048 -171.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.451 2.2 t -124.88 149.7 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 113.46 -3.296 . . . . 0.0 116.416 168.745 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 34.4 t -161.39 172.91 15.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.162 1.385 . . . . 0.0 108.302 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.92 145.7 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 30.2 t -85.55 157.93 20.27 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 122.744 0.418 . . . . 0.0 110.877 177.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -96.57 -4.32 41.46 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.435 -0.166 . . . . 0.0 110.777 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -78.95 152.15 76.84 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.736 0.814 . . . . 0.0 111.111 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.13 -34.81 1.04 Allowed 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.56 2.84 . . . . 0.0 112.068 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.28 159.76 10.97 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 122.961 0.504 . . . . 0.0 111.107 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.3 mt -78.27 136.7 23.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 61.4 mmm -103.59 125.12 35.7 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 122.311 0.244 . . . . 0.0 110.975 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -78.16 173.31 14.1 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.904 3.07 . . . . 0.0 110.187 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 128.52 -108.57 0.92 Allowed Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -72.42 153.17 41.56 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.349 0.659 . . . . 0.0 110.679 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.2 p -159.04 175.22 13.8 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.28 0.632 . . . . 0.0 110.095 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -143.33 163.82 31.97 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.91 135.11 14.5 Favored Glycine 0 CA--C 1.525 0.659 0 O-C-N 122.099 -0.376 . . . . 0.0 112.66 -174.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.34 165.58 14.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.253 0.621 . . . . 0.0 109.516 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -72.7 -19.54 61.38 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.162 -0.336 . . . . 0.0 111.732 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -120.52 24.9 10.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.088 0.555 . . . . 0.0 109.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.2 -159.62 13.08 Favored Glycine 0 C--N 1.337 0.631 0 O-C-N 121.715 -0.616 . . . . 0.0 111.817 -177.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.5 t -133.09 -17.86 2.36 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.8 t -127.1 143.53 51.25 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.73 0.412 . . . . 0.0 110.04 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.6 p -86.74 1.59 51.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 123.168 0.587 . . . . 0.0 111.809 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.258 19.6 t80 -128.57 145.72 51.05 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 115.634 1.716 . . . . 0.0 115.634 -178.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -153.61 149.5 27.66 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.857 0.463 . . . . 0.0 109.952 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.251 0.1 OUTLIER -130.2 140.87 50.69 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 179.006 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 474' ' ' PHE . . . . . 0.408 ' HB3' HG21 ' A' ' 406' ' ' VAL 0.267 65.7 m-85 -111.75 -2.43 15.3 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -178.653 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 44.7 t -73.59 -26.31 60.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.13 14.99 2.06 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.699 0.8 . . . . 0.0 111.028 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 48.3 t -137.24 169.23 18.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.604 0.762 . . . . 0.0 110.56 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.04 6.49 31.2 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.111 0.565 . . . . 0.0 111.569 -176.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -62.06 -18.5 60.85 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' ASN . . . . . 0.469 ' HB3' HG22 ' A' ' 406' ' ' VAL . 0.4 OUTLIER -59.08 117.92 5.25 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.098 0.559 . . . . 0.0 111.657 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -81.17 -33.59 32.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.277 62.3 m-85 -97.94 3.5 49.6 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -176.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 57.8 m -87.76 7.0 32.32 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -172.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.448 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.77 144.46 53.0 Favored Pre-proline 0 C--O 1.231 0.1 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 177.278 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 485' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.0 Cg_exo -64.66 -29.58 60.36 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.024 2.482 . . . . 0.0 112.372 -178.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -81.33 -26.4 35.66 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.667 -0.206 . . . . 0.0 111.18 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -82.25 -42.35 19.01 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.29 0.496 . . . . 0.0 110.906 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.35 -16.45 54.52 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.97 -21.52 33.98 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -124.04 4.13 8.64 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -64.02 155.44 31.14 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.779 0.718 . . . . 0.0 111.493 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -144.06 126.21 15.56 Favored 'General case' 0 N--CA 1.458 -0.062 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -174.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.8 mm -148.63 123.25 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 C-N-CA 124.351 1.06 . . . . 0.0 108.324 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -162.1 97.68 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.901 0.318 . . . . 0.0 110.781 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' HIS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 496' ' ' PRO . 15.1 p80 54.32 155.13 0.05 OUTLIER Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 127.501 2.32 . . . . 0.0 114.596 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 496' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 495' ' ' HIS . 91.5 Cg_endo -75.7 76.2 3.75 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.536 2.824 . . . . 0.0 109.837 176.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.1 t -65.01 161.0 19.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.129 0.572 . . . . 0.0 110.856 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -83.84 -7.41 59.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 5.0 t -85.32 148.7 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.952 0.901 . . . . 0.0 110.8 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 10.2 tp -136.59 151.57 49.5 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -123.25 146.21 48.04 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -140.13 155.64 46.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.459 0.647 . . . . 0.0 109.34 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -148.44 163.77 36.15 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 104.423 -2.436 . . . . 0.0 104.423 -174.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 60.94 57.23 2.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.733 0.813 . . . . 0.0 112.044 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -137.39 137.09 21.42 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.945 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -49.83 159.91 1.42 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.863 3.042 . . . . 0.0 113.038 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 507' ' ' LEU . . . . . 0.559 HD12 ' H ' ' A' ' 507' ' ' LEU . 2.9 mp -68.52 -16.5 63.9 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -173.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.6 19.93 11.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 15.2 m -71.55 5.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.67 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.8 OUTLIER -54.88 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 117.497 -1.24 . . . . 0.0 113.223 -167.69 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.67 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -23.64 -37.29 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -171.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 92.9 mt-10 -56.85 -49.74 74.56 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 117.416 -1.278 . . . . 0.0 114.009 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -85.1 -25.75 27.34 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 122.286 2.312 . . . . 0.0 106.69 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -65.87 -38.37 88.61 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -74.44 -42.12 59.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.47 -24.64 59.07 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.094 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -74.48 -38.68 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.27 0.486 . . . . 0.0 109.983 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 93.5 m -67.41 -36.61 81.61 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 122.023 -0.423 . . . . 0.0 110.863 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -69.62 -29.18 66.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -76.58 -27.36 55.81 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 122.15 0.18 . . . . 0.0 111.186 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 80.1 mt -96.07 -6.06 39.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.893 0.477 . . . . 0.0 111.62 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.47 -8.57 25.81 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-O 119.472 -0.627 . . . . 0.0 113.195 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 m -76.92 155.37 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 118.384 1.092 . . . . 0.0 112.022 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -68.54 151.12 47.22 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.297 0.57 . . . . 0.0 112.024 -173.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -71.94 155.04 92.4 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.984 0.913 . . . . 0.0 111.286 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.24 155.1 65.12 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.387 2.725 . . . . 0.0 110.949 175.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -88.38 -20.57 25.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 14.1 t -153.91 164.03 39.08 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 110.994 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 3.1 p -160.34 146.81 5.93 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 C-N-CA 123.119 0.568 . . . . 0.0 109.469 -176.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -143.23 137.8 29.2 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.166 0.986 . . . . 0.0 108.929 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.2 146.99 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.343 0.657 . . . . 0.0 110.834 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -155.38 174.84 14.66 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 -173.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 80.8 p -62.93 134.78 56.73 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.503 0.668 . . . . 0.0 110.347 177.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -70.84 163.96 53.49 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.502 -175.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -81.05 12.13 3.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.411 1.084 . . . . 0.0 111.5 177.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 30.2 t -155.38 -172.73 4.27 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.335 1.054 . . . . 0.0 108.968 -177.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.85 -7.88 32.36 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -89.55 110.4 21.25 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.428 0.691 . . . . 0.0 110.593 172.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 68.2 m 53.6 -163.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.882 0.873 . . . . 0.0 112.954 174.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 20.7 m -140.8 178.49 7.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.523 1.129 . . . . 0.0 110.896 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.8 m -137.6 168.56 19.42 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . -174.88 179.32 46.26 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.669 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -121.75 158.4 28.87 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.729 0.812 . . . . 0.0 109.864 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.1 mt -141.26 166.7 24.05 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 124.728 1.211 . . . . 0.0 109.385 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -153.85 150.74 28.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.193 -0.317 . . . . 0.0 110.708 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 20.8 m-90 -130.54 165.52 22.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.792 1.237 . . . . 0.0 111.638 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -68.17 -7.04 26.63 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.2 t -160.13 160.92 33.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.559 0.344 . . . . 0.0 110.794 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -67.46 -27.96 67.47 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 177.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.0 m -76.95 -26.58 54.18 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.462 0.305 . . . . 0.0 110.727 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.19 -36.89 66.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 177.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.95 -24.55 52.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 175.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.9 tp -78.79 -36.81 42.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.895 0.478 . . . . 0.0 111.481 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -75.22 -38.73 60.55 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.85 -24.41 64.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.33 -33.7 73.52 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.42 -27.03 73.26 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.34 9.1 m-85 -100.31 -6.11 26.39 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 118.961 2.949 . . . . 0.0 118.961 177.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.6 mt -123.9 -9.42 7.76 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -73.36 139.69 46.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.838 1.199 . . . . 0.0 109.356 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 56.19 17.44 2.76 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.311 1.045 . . . . 0.0 112.719 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -70.32 138.94 51.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -74.42 129.55 37.98 Favored 'General case' 0 N--CA 1.455 -0.185 0 O-C-N 122.195 -0.315 . . . . 0.0 111.083 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.9 mtm -83.53 152.45 24.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.569 0.223 . . . . 0.0 111.122 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 64.4 pttt . . . . . 0 CA--C 1.532 0.269 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.933 178.524 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.262 4.7 p90 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.4 157.06 57.51 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.588 2.859 . . . . 0.0 112.264 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.87 142.46 50.66 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 102.807 -3.035 . . . . 0.0 102.807 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -73.35 137.56 44.81 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -86.3 138.25 31.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.928 1.291 . . . . 0.0 108.145 175.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.99 146.57 50.62 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.597 0.635 . . . . 0.0 110.458 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.3 161.29 39.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.091 0.472 . . . . 0.0 111.281 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.53 172.14 14.85 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.039 0.935 . . . . 0.0 110.166 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -54.99 121.96 9.85 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 32.1 t -78.65 152.33 31.75 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.4 t -118.61 10.64 12.59 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 170.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.33 162.49 14.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.47 0.652 . . . . 0.0 111.867 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -82.99 8.88 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.894 0.878 . . . . 0.0 112.741 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -160.2 178.11 9.98 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.475 0.579 . . . . 0.0 111.31 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.51 12.43 1.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.085 0.954 . . . . 0.0 110.112 169.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.39 -1.29 . . . . 0.0 110.401 -176.391 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 N--CA 1.454 -0.805 0 N-CA-C 110.84 -0.485 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -147.3 153.37 39.65 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 122.836 0.455 . . . . 0.0 110.719 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -76.28 159.47 30.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.767 0.427 . . . . 0.0 110.714 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -82.44 1.48 37.3 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.4 t -157.77 145.38 13.72 Favored Pre-proline 0 N--CA 1.456 -0.174 0 C-N-CA 122.83 0.452 . . . . 0.0 110.69 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.54 -15.05 41.04 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.661 2.907 . . . . 0.0 110.676 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 t -88.93 149.0 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.57 155.88 47.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.253 1.021 . . . . 0.0 108.429 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.1 tpt -139.37 133.76 31.55 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 122.01 -0.431 . . . . 0.0 110.808 -174.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.16 153.53 37.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -139.48 166.45 24.53 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 90.68 9.48 64.37 Favored Glycine 0 CA--C 1.529 0.954 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.659 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.8 mt -78.1 25.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.77 0.785 . . . . 0.0 112.483 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -67.49 -15.57 63.74 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -72.21 155.36 40.31 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.644 -0.66 . . . . 0.0 111.958 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.8 p -68.72 -9.17 48.98 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 123.591 0.756 . . . . 0.0 111.328 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -95.63 5.08 52.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.723 0.809 . . . . 0.0 111.254 -173.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 59.1 mmm -106.33 138.14 43.04 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -177.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -160.18 157.98 29.3 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.443 0.697 . . . . 0.0 109.863 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 92.9 m -52.27 -41.76 63.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.58 0.352 . . . . 0.0 111.668 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -72.17 -36.51 69.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -76.02 -47.25 25.58 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -174.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 18.6 t -69.75 -40.78 79.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.404 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 3.6 t80 -78.27 -31.34 49.01 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.009 -170.045 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -74.66 -31.05 61.81 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 119.897 1.226 . . . . 0.0 109.84 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.78 -56.48 17.58 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.556 2.3 p90 -76.55 -3.79 39.36 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 174.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 35.7 t -75.05 -35.11 61.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 122.07 -0.394 . . . . 0.0 111.357 177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.4 -15.46 36.85 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -80.69 -7.18 59.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.91 2.189 . . . . 0.0 116.91 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -179.54 -130.64 1.49 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 118.289 0.495 . . . . 0.0 111.963 -175.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -136.49 124.15 22.38 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.404 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.4 m -114.02 165.46 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -174.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -118.04 -61.49 1.67 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 408' ' ' LYS . . . . . 0.402 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 19.4 pttm -154.38 166.16 34.09 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.5 p -145.57 152.03 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 C-N-CA 124.604 1.162 . . . . 0.0 109.828 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -155.62 131.84 10.16 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.254 3.3 m-85 -82.73 164.03 20.92 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 116.871 2.175 . . . . 0.0 116.871 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.8 mmt -106.7 120.4 41.89 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.336 0.654 . . . . 0.0 112.44 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -79.1 -20.52 48.5 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.625 0.77 . . . . 0.0 111.31 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 42.3 t -81.45 -19.51 42.25 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.061 0.545 . . . . 0.0 112.355 -175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -115.64 157.87 43.28 Favored Pre-proline 0 N--CA 1.456 -0.156 0 C-N-CA 123.371 0.669 . . . . 0.0 109.759 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 -18.55 55.9 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.712 2.275 . . . . 0.0 110.791 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.64 103.82 0.17 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 176.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.36 162.37 33.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.802 0.841 . . . . 0.0 109.194 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.13 147.0 16.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 112.067 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 80.2 mtp -90.02 152.82 21.0 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.308 170.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.63 152.56 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 123.603 0.761 . . . . 0.0 110.228 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -136.31 130.35 32.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.595 0.634 . . . . 0.0 109.84 175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.0 mtp -151.0 171.22 17.63 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.449 0.7 . . . . 0.0 109.14 -169.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.52 123.27 19.2 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -72.61 -33.43 66.67 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -167.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.9 -88.66 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -72.27 -26.47 62.0 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -175.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.15 -34.23 15.94 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.265 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.18 -24.44 6.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 118.096 -1.442 . . . . 0.0 109.155 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -67.6 -50.41 58.38 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.527 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -65.18 -38.88 91.9 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.53 -37.51 85.17 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.785 0.72 . . . . 0.0 109.987 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 57.8 mt -77.45 -9.08 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.453 0.701 . . . . 0.0 111.713 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 76.7 m -102.85 -15.52 16.19 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -133.11 -24.81 1.84 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 -169.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.5 mp -133.98 -12.33 2.55 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.385 1.448 . . . . 0.0 113.329 -172.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -70.97 101.15 2.12 Favored 'General case' 0 C--O 1.206 -1.208 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -169.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.1 m-80 77.1 22.07 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 124.518 3.326 . . . . 0.0 113.669 -161.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.12 162.94 20.1 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 167.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -81.21 138.61 35.8 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.3 ttt -153.74 137.85 16.45 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.46 0.704 . . . . 0.0 109.71 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.5 m-85 57.46 21.53 7.07 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.95 7.33 66.15 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.44 -0.644 . . . . 0.0 113.089 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -149.91 154.27 38.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.03 0.915 . . . . 0.0 110.579 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -73.96 146.21 44.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.996 0.518 . . . . 0.0 111.818 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -125.12 84.45 2.28 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.243 1.017 . . . . 0.0 108.814 175.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.5 m120 -55.16 128.39 33.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.756 -170.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.0 t -126.99 149.0 31.76 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 C-N-CA 113.486 -3.286 . . . . 0.0 115.848 168.545 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.6 t -160.28 170.7 20.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.554 1.542 . . . . 0.0 107.763 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.1 148.87 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 20.6 t -83.36 166.47 18.41 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 122.983 0.513 . . . . 0.0 110.634 177.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.86 11.69 10.41 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -85.15 152.84 59.14 Favored Pre-proline 0 CA--C 1.532 0.259 0 C-N-CA 123.46 0.704 . . . . 0.0 110.22 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -65.49 -46.57 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.888 2.392 . . . . 0.0 112.468 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -170.02 160.29 8.13 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.902 0.881 . . . . 0.0 109.751 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.402 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 69.8 mt -77.91 143.08 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.2 mtp -114.16 134.12 22.26 Favored Pre-proline 0 N--CA 1.454 -0.236 0 O-C-N 122.407 -0.183 . . . . 0.0 111.033 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.38 161.47 40.17 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.497 2.798 . . . . 0.0 109.282 174.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 159.76 -132.15 2.91 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -72.47 161.79 30.34 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.892 0.477 . . . . 0.0 110.021 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.0 p -149.3 168.78 22.4 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.341 0.656 . . . . 0.0 110.03 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -129.34 -1.25 5.05 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.49 -178.95 46.98 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 -178.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.79 159.43 42.88 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.162 0.985 . . . . 0.0 109.453 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -76.7 -9.28 58.56 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -120.62 24.93 10.05 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.611 0.764 . . . . 0.0 110.249 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.89 -152.97 9.34 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.0 m -133.01 -12.67 2.85 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 178.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 19.4 p -127.04 150.86 49.25 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.274 0.63 . . . . 0.0 111.924 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.2 p -99.8 4.74 45.44 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.334 0.653 . . . . 0.0 110.884 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -141.6 148.24 38.91 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.374 1.47 . . . . 0.0 113.574 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -151.08 156.15 40.45 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 118.274 0.488 . . . . 0.0 111.291 -176.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -127.96 137.08 52.12 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -129.92 -1.78 4.69 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -68.22 -30.59 69.69 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.643 0.377 . . . . 0.0 111.749 -174.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -91.19 -2.72 57.45 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.683 0.393 . . . . 0.0 111.418 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 46.3 t -96.3 151.31 19.64 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.821 0.449 . . . . 0.0 111.927 -176.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -90.97 5.3 49.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.874 0.47 . . . . 0.0 111.183 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.05 -22.3 65.64 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.678 0.391 . . . . 0.0 111.656 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -60.71 137.7 58.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.905 0.482 . . . . 0.0 109.917 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 481' ' ' ARG . 48.7 tpt85 -72.12 -24.75 61.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.16 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.269 51.8 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 88.6 p -61.19 -22.16 64.49 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -169.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.59 157.72 67.44 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.48 -23.8 75.11 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.876 2.384 . . . . 0.0 111.298 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -80.96 -31.78 34.7 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -76.97 -28.11 55.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -73.45 -21.38 60.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 122.652 0.381 . . . . 0.0 110.72 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.9 -12.97 58.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.879 0.472 . . . . 0.0 111.895 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -123.97 16.53 9.3 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.966 0.507 . . . . 0.0 110.676 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 149.17 48.58 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 111.41 -174.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -145.6 130.46 18.17 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 30.1 mm -140.53 137.54 36.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 122.777 0.431 . . . . 0.0 110.153 -175.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -152.26 167.42 28.66 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.44 1.096 . . . . 0.0 109.624 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -64.74 157.61 73.38 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.63 148.61 92.63 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.37 2.047 . . . . 0.0 109.584 178.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -152.46 174.72 13.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -83.82 -7.66 59.4 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -86.76 140.24 16.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 112.328 173.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 14.4 tp -137.56 142.72 41.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -112.32 150.93 30.33 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.783 0.833 . . . . 0.0 109.406 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -146.46 160.22 42.37 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.456 0.646 . . . . 0.0 109.646 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -151.63 167.55 27.77 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 32.8 m120 53.28 55.71 8.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.612 0.365 . . . . 0.0 111.427 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.22 152.85 52.92 Favored Pre-proline 0 CA--C 1.531 0.217 0 C-N-CA 122.323 0.249 . . . . 0.0 110.454 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.15 152.4 38.06 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.152 2.568 . . . . 0.0 112.157 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.78 -16.4 63.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.97 0.508 . . . . 0.0 112.203 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -122.06 24.62 9.45 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.615 0.766 . . . . 0.0 110.897 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.74 -13.23 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 -176.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.682 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.3 -178.37 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -166.484 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.682 ' H ' HG22 ' A' ' 510' ' ' THR . 23.0 pt-20 -20.23 -42.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.6 mt-10 -56.15 -49.24 74.52 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 172.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -87.17 -27.04 23.26 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 122.034 2.197 . . . . 0.0 106.732 -173.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -64.95 -39.92 94.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -70.53 -44.42 67.55 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -75.31 -26.56 58.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.085 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.3 mt -71.6 -37.38 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.044 0 CA-C-N 118.858 0.754 . . . . 0.0 110.203 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 94.5 m -67.3 -29.97 69.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.897 -0.502 . . . . 0.0 111.026 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -73.85 -28.98 61.86 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -78.36 -11.51 59.95 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.98 -4.88 12.52 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.173 0.589 . . . . 0.0 111.55 -179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.8 3.87 60.57 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 123.572 0.606 . . . . 0.0 112.82 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.94 157.13 5.46 Favored 'Isoleucine or valine' 0 C--N 1.339 0.129 0 CA-C-N 117.831 0.815 . . . . 0.0 112.813 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.53 144.5 55.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.575 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 55.3 ptt85 -80.81 149.43 67.32 Favored Pre-proline 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.63 148.3 65.57 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 123.058 2.505 . . . . 0.0 110.311 177.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.7 t -85.64 -21.01 28.62 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -146.84 154.64 41.57 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 122.978 0.511 . . . . 0.0 110.786 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 76.8 t -144.72 145.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 123.649 0.779 . . . . 0.0 109.913 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -152.85 143.63 22.85 Favored 'General case' 0 C--N 1.337 0.049 0 C-N-CA 123.002 0.521 . . . . 0.0 109.994 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -138.62 150.64 23.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.057 0 C-N-CA 123.43 0.692 . . . . 0.0 112.13 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -154.85 -178.72 7.42 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -178.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.8 t -134.06 -177.76 4.72 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.307 1.043 . . . . 0.0 109.77 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 99.76 9.82 48.44 Favored Glycine 0 CA--C 1.527 0.826 0 CA-C-O 119.746 -0.474 . . . . 0.0 111.97 -177.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -125.67 -26.07 3.58 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 117.659 0.729 . . . . 0.0 112.5 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.3 t -164.52 155.09 14.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.812 0.445 . . . . 0.0 110.587 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -103.43 -8.05 20.48 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.038 0.535 . . . . 0.0 110.532 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -78.47 -38.42 41.06 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 122.723 0.409 . . . . 0.0 112.055 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 58.4 m -156.06 167.7 29.57 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 111.399 -171.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -83.8 167.52 17.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.644 0.778 . . . . 0.0 110.825 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -151.52 160.21 43.79 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 124.322 1.049 . . . . 0.0 108.616 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.05 -168.46 41.6 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.833 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.02 160.27 22.32 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.507 0.723 . . . . 0.0 110.827 -179.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.4 mt -138.06 161.76 35.92 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.268 1.427 . . . . 0.0 107.921 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -151.64 147.41 26.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.244 -0.285 . . . . 0.0 110.873 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -125.03 173.54 8.62 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.722 1.209 . . . . 0.0 112.723 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -74.68 -7.55 53.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.8 t -158.98 158.26 32.89 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 122.484 0.314 . . . . 0.0 111.119 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -68.05 -27.91 66.93 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.501 0.32 . . . . 0.0 110.532 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 85.3 p -77.08 -23.77 51.89 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.273 0.229 . . . . 0.0 110.839 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -76.82 -35.51 57.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.248 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.19 -28.49 61.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 122.187 -0.321 . . . . 0.0 110.353 174.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.4 tp -73.09 -42.98 62.42 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.061 0.544 . . . . 0.0 111.17 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -70.2 -35.3 73.83 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -178.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.82 -21.85 63.35 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.57 -39.19 88.36 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.07 -26.94 73.63 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.761 -0.466 . . . . 0.0 112.309 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.347 10.6 m-85 -102.16 -1.23 31.83 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 119.437 3.125 . . . . 0.0 119.437 179.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 60.4 mt -135.79 -4.59 2.23 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.828 1.195 . . . . 0.0 114.137 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.92 143.89 47.54 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 119.962 1.255 . . . . 0.0 109.094 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.87 15.41 3.85 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.369 1.068 . . . . 0.0 113.341 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -70.06 139.04 52.55 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -73.93 136.9 43.33 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.822 -0.549 . . . . 0.0 111.942 -175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.4 mtm -83.57 152.56 24.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.894 0.478 . . . . 0.0 110.676 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.8 pttp . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.083 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.66 165.26 30.66 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.933 3.089 . . . . 0.0 111.414 177.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.91 142.35 50.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 102.825 -3.028 . . . . 0.0 102.825 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.7 143.53 42.07 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.4 tt -89.05 152.22 21.8 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.601 1.16 . . . . 0.0 108.95 173.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.95 150.75 44.9 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.023 -0.423 . . . . 0.0 110.777 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.27 162.05 40.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 22.3 p -165.49 168.27 16.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -54.94 129.58 38.21 Favored 'General case' 0 N--CA 1.457 -0.09 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.7 t -81.16 148.57 29.51 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -114.04 8.21 17.0 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 169.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.98 158.91 21.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.068 0.947 . . . . 0.0 111.744 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -91.84 -3.41 56.1 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.489 -178.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -154.53 172.77 17.27 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.553 0.741 . . . . 0.0 110.541 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.97 23.36 1.37 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.972 0.909 . . . . 0.0 109.802 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.253 1.255 0 CA-C-O 117.427 -1.273 . . . . 0.0 110.515 -176.416 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo . . . . . 0 N--CA 1.456 -0.731 0 N-CA-C 110.942 -0.445 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -142.99 157.24 44.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.89 0.476 . . . . 0.0 110.765 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.97 158.93 34.5 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.514 0.725 . . . . 0.0 110.948 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -73.74 -4.39 34.27 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -158.08 147.91 15.33 Favored Pre-proline 0 N--CA 1.456 -0.131 0 C-N-CA 123.177 0.591 . . . . 0.0 110.035 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.27 -15.22 47.47 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.908 2.406 . . . . 0.0 110.322 174.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.5 t -91.26 154.79 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.583 0.753 . . . . 0.0 112.752 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.8 tt -140.41 152.07 45.42 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 125.152 1.381 . . . . 0.0 108.297 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -134.8 134.34 40.76 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.452 0.301 . . . . 0.0 111.033 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -129.91 152.71 37.78 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.069 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -142.96 173.75 11.28 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 86.62 11.29 71.56 Favored Glycine 0 CA--C 1.527 0.808 0 O-C-N 122.242 -0.286 . . . . 0.0 112.48 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 41.2 mt -76.3 39.68 0.2 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.739 0.816 . . . . 0.0 110.998 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -74.34 18.67 0.15 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -136.98 156.27 48.65 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.943 0.497 . . . . 0.0 111.439 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 36.6 t -69.19 -15.38 63.38 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.52 0.728 . . . . 0.0 111.883 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -74.28 5.01 4.91 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 91.0 mmm -114.18 141.37 47.6 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.301 0.501 . . . . 0.0 110.782 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -162.36 168.02 22.83 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.568 1.147 . . . . 0.0 108.963 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 95.1 m -54.83 -32.11 60.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.902 0.481 . . . . 0.0 111.981 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.36 -38.6 60.0 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -66.39 -48.3 70.55 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -177.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.23 -49.41 84.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.422 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.268 1.4 m-85 -61.14 -56.87 15.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 178.025 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -57.44 -33.81 68.31 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.792 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.21 -64.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.572 0.5 OUTLIER -76.56 -5.52 48.01 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 176.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 50.5 t -74.77 -32.24 62.0 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.5 pp -63.3 -17.6 62.71 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.629 172.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -91.73 -8.83 45.8 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.73 -179.26 41.7 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 118.375 0.534 . . . . 0.0 112.455 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -80.67 129.99 34.84 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 122.599 -0.353 . . . . 0.0 110.958 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 0.8 OUTLIER -114.05 165.55 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.451 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -129.29 -63.34 0.95 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -154.42 158.81 40.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.295 0.952 . . . . 0.0 113.157 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 409' ' ' VAL . . . . . 0.41 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.5 p -138.52 150.94 24.09 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 C-N-CA 123.908 0.883 . . . . 0.0 110.267 -175.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -150.78 122.14 7.86 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.964 0.906 . . . . 0.0 110.417 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.259 6.6 m-85 -80.51 155.43 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 177.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 mmt -100.26 115.96 31.13 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.783 0.433 . . . . 0.0 110.949 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -79.15 -14.26 59.21 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.69 0.396 . . . . 0.0 111.341 172.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.7 p -85.0 -5.48 59.35 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.322 0.649 . . . . 0.0 112.251 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -126.21 156.73 71.83 Favored Pre-proline 0 CA--C 1.529 0.153 0 C-N-CA 123.554 0.741 . . . . 0.0 109.903 -177.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.63 -15.06 40.77 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.189 2.593 . . . . 0.0 111.592 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.19 92.07 0.08 OUTLIER Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.99 159.72 41.75 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.38 166.7 32.65 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.276 0.56 . . . . 0.0 110.578 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 41.1 ttp -129.49 147.43 51.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.275 1.03 . . . . 0.0 109.065 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.67 157.05 20.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -137.17 133.83 35.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 26.3 mtm -153.02 177.96 10.22 Favored 'General case' 0 C--O 1.23 0.078 0 C-N-CA 123.934 0.894 . . . . 0.0 109.957 -173.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.09 118.64 10.13 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 171.044 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -72.3 -33.3 67.3 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -168.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.69 -86.21 0.02 OUTLIER Glycine 0 C--N 1.335 0.524 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -177.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -74.5 -28.53 61.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.81 -34.06 18.4 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.984 -174.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.4 t -88.76 -23.99 6.17 Favored 'Isoleucine or valine' 0 C--N 1.341 0.225 0 C-N-CA 118.828 -1.149 . . . . 0.0 109.47 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.83 -52.06 33.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.943 174.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -68.17 -32.7 73.13 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 121.874 -0.516 . . . . 0.0 112.386 -176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.67 -34.19 75.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 118.721 0.691 . . . . 0.0 110.584 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.53 -12.69 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.31 0.644 . . . . 0.0 110.731 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.7 m -92.42 -21.24 20.31 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -128.6 -28.17 2.53 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.72 -15.16 7.99 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 120.486 1.494 . . . . 0.0 114.447 -172.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.646 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 32.5 p-10 -71.63 100.82 2.38 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 116.83 2.159 . . . . 0.0 116.83 -167.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.624 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 12.1 m-80 76.84 21.95 1.14 Allowed 'General case' 0 N--CA 1.482 1.144 0 O-C-N 117.743 -3.098 . . . . 0.0 113.199 -161.464 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -81.03 163.13 23.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.873 -1.142 . . . . 0.0 108.769 167.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -82.62 140.94 32.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.9 ttt -159.7 138.7 10.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.09 0.556 . . . . 0.0 110.15 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.419 46.4 m-85 57.03 20.71 5.64 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.91 70.67 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -134.19 -167.58 1.98 Allowed 'General case' 0 C--O 1.231 0.092 0 C-N-CA 124.326 1.05 . . . . 0.0 108.866 177.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -129.71 143.08 50.65 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.8 ptm -118.02 84.59 2.2 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.991 0.517 . . . . 0.0 110.393 -177.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 2.7 m-20 -54.44 128.4 31.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.779 -173.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.646 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.441 2.3 t -126.19 154.38 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 113.286 -3.366 . . . . 0.0 115.848 168.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 45.8 t -162.99 166.79 23.34 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.477 1.511 . . . . 0.0 108.716 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 10.2 t -68.61 145.16 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 O-C-N 121.855 -0.528 . . . . 0.0 112.084 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.4 t -84.41 155.99 22.01 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.635 0.374 . . . . 0.0 111.144 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -96.54 -9.62 29.1 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.51 -0.119 . . . . 0.0 110.711 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -76.31 148.51 80.77 Favored Pre-proline 0 N--CA 1.454 -0.264 0 C-N-CA 123.404 0.682 . . . . 0.0 110.658 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.22 -32.87 3.79 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.364 2.71 . . . . 0.0 111.617 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.81 157.89 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.286 0.634 . . . . 0.0 110.671 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 17.7 mt -82.58 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 49.7 mmm -93.9 119.78 66.54 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 122.476 0.31 . . . . 0.0 110.382 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.49 154.47 45.13 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.213 2.609 . . . . 0.0 109.337 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 154.53 -113.06 0.55 Allowed Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.38 163.49 27.91 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.499 0.666 . . . . 0.0 111.905 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 14.7 t -157.37 160.12 38.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.44 1.096 . . . . 0.0 109.632 -177.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -130.07 0.73 4.72 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.39 175.07 44.76 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 93.8 mt -143.41 157.03 44.79 Favored 'General case' 0 N--CA 1.458 -0.074 0 C-N-CA 124.235 1.014 . . . . 0.0 109.179 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -75.6 -8.04 55.77 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . 0.253 11.9 t0 -120.49 26.89 8.89 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 122.039 0.923 . . . . 0.0 112.665 175.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.51 -150.83 7.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 69.4 m -133.05 -16.9 2.45 Favored 'General case' 0 N--CA 1.458 -0.07 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.9 m -127.04 149.14 50.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.863 0.465 . . . . 0.0 111.368 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.9 p -89.77 7.19 38.15 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 110.137 173.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -139.77 148.64 42.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.993 1.317 . . . . 0.0 113.275 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -154.7 158.2 39.23 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.05 0.387 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -127.7 136.65 51.86 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -134.07 4.66 3.52 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -179.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -64.85 -22.01 66.91 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.127 0.571 . . . . 0.0 112.046 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -114.02 1.21 14.59 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.05 0.54 . . . . 0.0 111.777 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.9 m -75.73 149.81 37.96 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.023 0.44 . . . . 0.0 111.53 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -80.12 -11.14 59.78 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.157 0.583 . . . . 0.0 111.151 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -62.05 -23.93 66.78 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.155 0.582 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -60.89 128.68 37.68 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.832 0.453 . . . . 0.0 110.27 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -73.18 -33.64 65.54 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.349 61.0 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -63.87 -21.95 66.69 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -173.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -135.19 150.5 72.95 Favored Pre-proline 0 C--O 1.23 0.071 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.6 -25.45 24.69 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.24 2.627 . . . . 0.0 111.412 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -80.03 -22.55 42.26 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.01 -0.431 . . . . 0.0 110.509 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -82.21 -41.65 20.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 172.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.26 -20.08 63.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.653 0.381 . . . . 0.0 111.858 -178.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.65 -19.71 48.45 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.472 0.309 . . . . 0.0 111.759 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -123.97 2.25 8.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -61.44 156.34 19.5 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.482 0.583 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -140.03 137.13 34.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -175.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.3 mm -141.12 144.02 27.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 123.595 0.758 . . . . 0.0 109.119 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -147.93 167.87 23.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.554 0.741 . . . . 0.0 111.086 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -63.0 155.36 73.07 Favored Pre-proline 0 N--CA 1.455 -0.196 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 172.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -66.01 135.49 41.0 Favored 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.191 1.927 . . . . 0.0 108.456 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -154.12 173.71 15.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.77 0.428 . . . . 0.0 110.076 -172.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -83.79 -8.77 59.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.7 -0.19 . . . . 0.0 111.161 -178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.64 138.04 20.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.2 tp -139.18 151.22 46.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -123.02 149.37 44.44 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.771 0.828 . . . . 0.0 108.906 -178.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -143.99 159.13 43.13 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -152.55 167.76 27.77 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.363 -2.458 . . . . 0.0 104.363 -176.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 60.61 57.53 2.71 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.174 0.59 . . . . 0.0 112.231 -173.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -136.08 122.46 14.02 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-O 119.442 -0.314 . . . . 0.0 111.186 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.67 164.1 1.06 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.944 3.096 . . . . 0.0 113.279 172.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.42 -17.3 64.18 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.887 0.875 . . . . 0.0 112.062 -175.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -97.93 3.98 49.55 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 47.0 t -73.07 -18.17 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.3 m -55.38 -177.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 117.638 -1.172 . . . . 0.0 113.813 -165.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -18.84 -44.53 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.254 1.822 . . . . 0.0 114.834 -169.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.0 mt-10 -57.06 -48.23 79.05 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 173.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -87.64 -28.36 21.9 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 121.968 2.167 . . . . 0.0 106.323 -173.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -61.88 -35.81 79.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -75.84 -42.72 48.83 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.07 -22.3 42.42 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.477 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.6 mt -75.58 -45.01 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.126 0 CA-C-N 118.417 0.553 . . . . 0.0 110.648 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 30.7 p -68.32 -32.11 72.01 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.045 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -64.77 -39.28 93.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.834 0.349 . . . . 0.0 111.924 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.5 tp10 -71.39 -28.58 64.13 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.584 0.353 . . . . 0.0 111.272 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.75 -4.74 59.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.233 0.613 . . . . 0.0 111.691 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.6 27.85 56.31 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.829 -0.429 . . . . 0.0 112.219 175.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 6.0 p -129.73 152.58 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 C-N-CA 123.263 0.625 . . . . 0.0 112.027 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -68.64 152.93 44.69 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 121.203 0.525 . . . . 0.0 111.802 -175.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -82.24 156.23 69.14 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.81 0.844 . . . . 0.0 110.607 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.24 153.21 77.93 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.261 2.641 . . . . 0.0 111.108 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -84.78 -15.49 44.78 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.8 t -153.5 160.85 42.63 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.37 149.37 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 C-N-CA 123.311 0.645 . . . . 0.0 109.491 -176.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -147.07 143.91 28.68 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.103 0.961 . . . . 0.0 108.816 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 4.7 t -138.83 143.2 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.058 0 C-N-CA 122.877 0.471 . . . . 0.0 111.998 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -152.89 -175.23 5.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.8 p -146.12 -171.5 3.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.886 0.874 . . . . 0.0 110.28 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 102.2 -10.18 56.59 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 123.97 0.795 . . . . 0.0 111.908 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -89.87 -27.22 20.05 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 117.597 0.699 . . . . 0.0 111.648 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 83.5 p -165.83 163.86 18.72 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.447 0.699 . . . . 0.0 109.581 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -97.04 -4.21 40.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.716 0.406 . . . . 0.0 110.914 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.63 -40.6 48.77 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 89.2 p -163.21 170.6 17.5 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.14 0.495 . . . . 0.0 111.052 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.0 p -83.27 174.2 10.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.33 0.652 . . . . 0.0 110.186 177.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.9 p -153.74 162.41 41.26 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.35 -170.5 43.34 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.057 -177.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.08 160.39 22.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.484 0.713 . . . . 0.0 110.288 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -138.66 161.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.932 1.293 . . . . 0.0 108.367 177.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.75 148.73 28.9 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.28 -0.262 . . . . 0.0 111.099 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 21.3 m-90 -127.87 173.19 10.2 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.715 1.206 . . . . 0.0 112.343 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -75.19 -10.36 59.4 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.617 0.367 . . . . 0.0 110.459 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -157.93 160.73 37.9 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 121.735 -0.603 . . . . 0.0 111.118 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -74.1 -22.34 59.52 Favored 'General case' 0 CA--C 1.527 0.089 0 O-C-N 122.386 -0.196 . . . . 0.0 110.942 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 88.3 p -77.78 -27.29 50.19 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -71.51 -35.93 70.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.4 56.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.0 tp -78.23 -41.73 33.37 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.398 0.279 . . . . 0.0 111.409 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -68.59 -39.04 81.09 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.2 m -67.7 -28.42 67.66 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.4 tt -71.22 -36.88 72.02 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.19 -32.04 75.14 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 119.632 -0.538 . . . . 0.0 111.831 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.326 9.8 m-85 -100.69 -14.5 18.07 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 119.114 3.005 . . . . 0.0 119.114 177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.69 -14.53 14.79 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.972 0.806 . . . . 0.0 112.031 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -70.09 140.93 52.81 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.397 0.999 . . . . 0.0 109.073 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.7 t60 55.47 20.29 3.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.673 1.189 . . . . 0.0 112.856 -178.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.35 135.57 52.02 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -75.98 130.93 39.18 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.121 -0.362 . . . . 0.0 111.492 -176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 61.6 mtm -100.95 152.67 20.28 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 123.145 0.578 . . . . 0.0 111.421 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 C--O 1.232 0.179 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 169.993 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.4 p90 . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -79.58 167.67 20.6 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 123.757 2.971 . . . . 0.0 111.946 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -128.83 142.35 51.0 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 170.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.281 0.6 OUTLIER -85.99 137.95 32.34 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -175.805 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.0 134.99 37.72 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.75 149.52 50.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 118.483 0.583 . . . . 0.0 110.574 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.53 162.49 39.93 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.864 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 21.9 p -163.73 170.82 16.45 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.398 0.679 . . . . 0.0 110.909 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -56.12 125.09 20.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 37.2 t -80.81 151.97 28.48 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.2 t -114.64 7.09 15.91 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.41 1.084 . . . . 0.0 113.767 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.83 163.95 20.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.148 0.979 . . . . 0.0 111.96 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -97.69 -2.84 40.48 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.608 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -154.55 170.27 21.87 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.518 0.727 . . . . 0.0 110.17 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.88 23.55 1.38 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.193 0.597 . . . . 0.0 110.45 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 117.627 -1.177 . . . . 0.0 110.74 -176.401 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo . . . . . 0 N--CA 1.453 -0.886 0 N-CA-C 110.848 -0.481 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -146.57 159.8 42.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.311 0.645 . . . . 0.0 110.352 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.73 157.41 38.08 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.585 0.354 . . . . 0.0 111.234 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -79.62 -3.03 45.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.111 0.564 . . . . 0.0 110.544 -177.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 47.1 t -155.97 151.13 21.1 Favored Pre-proline 0 CA--C 1.532 0.267 0 O-C-N 121.498 -0.751 . . . . 0.0 111.341 -177.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.29 -4.3 3.95 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.473 3.449 . . . . 0.0 114.03 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 380' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 451' ' ' SER . 6.5 m -128.47 165.77 27.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.95 0.881 . . . . 0.0 109.892 -174.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.65 159.57 41.96 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.937 1.695 . . . . 0.0 107.733 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.6 ttt -143.59 138.89 29.38 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.538 0.608 . . . . 0.0 111.145 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -121.19 154.44 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -175.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.44 171.09 14.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.1 13.13 72.23 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 122.141 -0.35 . . . . 0.0 112.302 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.28 28.34 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.747 0.819 . . . . 0.0 111.581 178.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -64.6 -26.33 68.36 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.424 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -76.84 149.44 36.17 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.064 0.459 . . . . 0.0 110.996 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.8 p -70.58 -6.73 38.73 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.615 0.766 . . . . 0.0 112.646 -176.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -77.95 -14.34 59.57 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.954 0.501 . . . . 0.0 112.021 -176.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 80.3 mmm -86.05 154.29 21.52 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.034 0.379 . . . . 0.0 111.23 -178.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -164.0 164.34 23.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.315 1.046 . . . . 0.0 108.509 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.0 p -64.03 -29.77 70.89 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.034 -0.416 . . . . 0.0 111.978 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.02 -26.86 36.09 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -70.96 -50.79 30.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.435 0.636 . . . . 0.0 109.606 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.15 -47.47 92.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 397' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.264 1.3 m-85 -63.25 -52.35 62.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 178.06 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -59.42 -33.86 71.77 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 120.16 1.346 . . . . 0.0 109.458 -172.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 15.0 t -62.48 -61.88 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.561 0.8 OUTLIER -76.51 -4.98 45.57 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 176.216 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 52.9 t -75.26 -32.57 61.11 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.6 pp -62.41 -19.55 63.56 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.561 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.43 -9.31 52.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 116.919 2.192 . . . . 0.0 116.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 159.12 178.29 32.99 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 118.298 0.499 . . . . 0.0 112.234 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -68.51 140.21 55.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.435 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 18.2 m -114.01 165.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.918 1.287 . . . . 0.0 109.339 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -137.47 -60.71 0.66 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.81 154.7 37.78 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 118.738 0.699 . . . . 0.0 112.855 -175.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.9 146.72 19.73 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 C-N-CA 123.181 0.592 . . . . 0.0 109.976 176.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.2 133.07 13.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.632 0.373 . . . . 0.0 110.555 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.271 11.8 m-85 -80.38 149.6 30.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.7 mmt -75.01 131.95 40.99 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.135 0.493 . . . . 0.0 111.553 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -79.24 -25.5 42.59 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.879 0.871 . . . . 0.0 111.827 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 94.8 p -101.94 -6.78 23.06 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -113.89 152.74 45.92 Favored Pre-proline 0 CA--C 1.529 0.171 0 CA-C-N 118.507 0.594 . . . . 0.0 110.193 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.34 -15.9 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.463 2.776 . . . . 0.0 112.168 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 179.84 91.3 0.08 OUTLIER Glycine 0 C--N 1.337 0.611 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.84 159.91 35.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.639 0.775 . . . . 0.0 109.308 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.11 142.04 18.07 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.747 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.6 ptm -91.39 150.43 21.28 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.4 t -138.86 151.28 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.558 0.743 . . . . 0.0 112.13 -173.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -131.89 132.82 43.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 84.9 mtp -155.2 172.91 17.38 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.463 0.705 . . . . 0.0 109.691 -171.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.88 112.07 3.59 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.264 -2.125 . . . . 0.0 105.264 169.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -72.46 -33.41 67.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -166.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.74 -87.42 0.01 OUTLIER Glycine 0 CA--C 1.52 0.351 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -74.52 -27.3 60.48 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.11 -34.39 17.92 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.798 -174.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 96.6 t -85.92 -25.85 6.47 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 118.525 -1.27 . . . . 0.0 108.576 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -63.89 -52.63 59.06 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.316 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -68.91 -31.89 71.13 Favored 'General case' 0 N--CA 1.457 -0.088 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.95 -34.58 78.43 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.559 0.618 . . . . 0.0 110.219 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 41.5 mt -77.92 -13.98 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.463 0.705 . . . . 0.0 110.926 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.9 m -91.97 -22.03 20.22 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.46 -20.24 3.32 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -169.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 63.9 mt -134.48 -14.56 2.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 33.1 p-10 -71.67 101.02 2.44 Favored 'General case' 0 C--O 1.198 -1.622 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 -169.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.596 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.3 m-80 76.87 22.06 1.12 Allowed 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.012 -2.93 . . . . 0.0 112.491 -161.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -85.79 162.93 18.45 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -78.72 141.94 37.48 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.8 ttt -162.03 137.85 7.61 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.262 0.625 . . . . 0.0 109.912 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.411 49.4 m-85 56.76 28.87 14.98 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.96 9.26 86.79 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -134.0 -167.67 1.99 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.036 1.334 . . . . 0.0 108.7 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -138.17 143.91 40.49 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.36 105.3 8.98 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.596 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 23.5 m-20 -64.08 132.02 49.25 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 115.709 -2.091 . . . . 0.0 111.729 -173.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.1 t -125.75 151.8 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 113.229 -3.388 . . . . 0.0 115.567 169.258 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -163.99 170.03 17.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.472 1.109 . . . . 0.0 108.568 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 5.5 t -69.85 144.31 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 451' ' ' SER . . . . . 0.449 ' HB3' HG23 ' A' ' 380' ' ' VAL . 15.9 t -87.66 153.88 21.03 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.057 0.543 . . . . 0.0 110.822 177.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -101.89 1.37 36.83 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -73.87 156.21 88.26 Favored Pre-proline 0 N--CA 1.454 -0.233 0 C-N-CA 123.272 0.629 . . . . 0.0 110.036 176.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -75.87 -42.69 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.667 2.245 . . . . 0.0 111.019 176.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -171.04 164.7 7.51 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 124.196 0.998 . . . . 0.0 109.457 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.09 137.72 21.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 7.8 mmm -107.33 132.6 20.84 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 122.542 0.337 . . . . 0.0 110.691 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.1 158.61 45.39 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.228 2.619 . . . . 0.0 109.105 173.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.82 -133.1 3.59 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.368 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -72.55 158.79 35.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.599 0.76 . . . . 0.0 110.75 -176.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -151.2 169.45 21.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.433 0.693 . . . . 0.0 109.766 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -122.65 1.68 9.47 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.51 -175.14 54.95 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.35 162.39 36.57 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 124.387 1.075 . . . . 0.0 109.165 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 11.0 pm0 -70.08 -22.01 63.09 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -120.49 13.41 11.76 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -159.04 167.13 34.8 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 121.986 -0.446 . . . . 0.0 112.17 -176.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 t -86.35 -29.79 22.7 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.782 0.433 . . . . 0.0 111.777 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 87.4 m -127.06 151.52 48.5 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.008 0.523 . . . . 0.0 111.639 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 84.4 p -82.24 7.27 14.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.262 0.625 . . . . 0.0 110.728 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -134.04 147.5 50.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.312 1.445 . . . . 0.0 114.824 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -152.63 153.45 33.36 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.883 0.473 . . . . 0.0 110.315 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.256 0.1 OUTLIER -133.98 145.73 49.78 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -127.33 10.78 6.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 34.6 t -65.33 -22.59 66.84 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.259 0.624 . . . . 0.0 111.91 -174.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -114.05 2.04 14.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.045 0.538 . . . . 0.0 111.637 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -77.32 146.51 36.71 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.766 0.317 . . . . 0.0 111.372 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -79.25 -8.21 58.86 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.393 0.277 . . . . 0.0 110.87 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -63.08 -21.66 66.33 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -59.04 123.35 16.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.566 0.346 . . . . 0.0 110.125 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -80.97 -32.6 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -176.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.285 55.1 m-85 -97.96 14.26 27.94 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.4 p -74.61 -6.67 49.89 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.28 149.83 69.05 Favored Pre-proline 0 C--O 1.23 0.059 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -71.4 -24.72 22.34 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 123.235 2.623 . . . . 0.0 111.301 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -81.37 -23.97 37.35 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.066 0.394 . . . . 0.0 110.751 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -82.84 -41.81 18.59 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 173.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.21 -18.18 64.27 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.462 0.305 . . . . 0.0 111.579 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.11 -18.9 52.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.757 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -2.54 8.14 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.54 152.6 41.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.872 0.76 . . . . 0.0 110.772 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -150.91 138.61 19.75 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.9 mt -139.78 145.66 26.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 123.829 0.851 . . . . 0.0 108.909 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -145.3 173.48 11.93 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.6 0.76 . . . . 0.0 110.523 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -56.99 154.3 19.79 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.088 0.555 . . . . 0.0 109.558 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -63.5 148.75 92.34 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.701 2.267 . . . . 0.0 110.097 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.1 t -152.57 167.39 29.01 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.804 -174.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.66 -0.69 51.73 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 122.315 -0.241 . . . . 0.0 111.051 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 3.0 t -97.57 134.53 35.28 Favored 'Isoleucine or valine' 0 C--O 1.231 0.084 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -117.51 157.76 25.73 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.865 0.866 . . . . 0.0 109.136 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -129.37 136.97 50.67 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.166 0.986 . . . . 0.0 108.37 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -125.82 158.07 35.94 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -177.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -147.63 165.52 30.16 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 103.656 -2.72 . . . . 0.0 103.656 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 57.95 57.42 4.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.882 0.473 . . . . 0.0 111.864 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -126.55 152.56 74.63 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.345 0.658 . . . . 0.0 110.322 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.413 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 74.0 Cg_endo -68.72 162.59 40.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.728 2.286 . . . . 0.0 110.658 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.46 -16.56 63.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.202 0.601 . . . . 0.0 111.317 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -112.54 22.26 14.79 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.329 0.651 . . . . 0.0 111.388 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.3 p -65.93 -15.12 18.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -176.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.88 -177.23 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 117.793 -1.098 . . . . 0.0 113.863 -165.587 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.615 ' H ' HG22 ' A' ' 510' ' ' THR . 23.5 pt-20 -27.32 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -169.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.9 mt-10 -57.57 -47.86 80.93 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 117.545 -1.217 . . . . 0.0 114.244 170.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -86.0 -27.67 24.68 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-N 122.287 2.312 . . . . 0.0 106.346 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.52 -33.53 75.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 176.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -77.52 -41.19 40.1 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.13 -28.45 57.44 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.015 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 69.9 mt -73.32 -40.22 56.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.115 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.42 -30.17 70.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.83 -43.7 71.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -68.86 -22.08 64.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 O-C-N 122.17 -0.331 . . . . 0.0 111.837 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.88 -5.23 48.44 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.923 0.489 . . . . 0.0 111.321 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.08 4.73 60.18 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-O 119.655 -0.525 . . . . 0.0 113.782 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.02 162.44 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 CA-C-N 118.154 0.977 . . . . 0.0 112.98 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -73.34 143.86 46.74 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 174.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -71.92 149.3 92.47 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 122.823 0.449 . . . . 0.0 111.193 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.38 155.9 62.88 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.622 2.881 . . . . 0.0 110.733 177.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -86.0 -17.95 33.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.4 t -154.8 156.79 36.89 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.515 0.198 . . . . 0.0 110.995 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 96.5 t -145.06 145.6 20.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 123.879 0.872 . . . . 0.0 110.199 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -146.92 145.9 29.95 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 123.252 0.621 . . . . 0.0 109.833 175.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 7.9 t -143.7 144.55 23.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -177.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -153.78 -175.43 5.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 91.8 p -133.59 -178.99 5.25 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.543 0.737 . . . . 0.0 110.756 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 97.43 -7.22 63.69 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.862 0.744 . . . . 0.0 112.375 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -86.69 -34.84 19.6 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.715 0.757 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 39.7 t -167.18 158.39 12.0 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.963 0.505 . . . . 0.0 110.265 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -96.89 -7.97 32.03 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.2 -28.85 19.7 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.433 0.693 . . . . 0.0 111.549 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.9 p -160.56 155.91 24.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.245 0.545 . . . . 0.0 112.044 -178.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.5 t -84.22 171.98 12.29 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 66.7 m -146.75 163.64 35.32 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.631 1.172 . . . . 0.0 109.455 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.98 -173.11 46.05 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.61 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -122.39 160.39 25.55 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.597 0.759 . . . . 0.0 110.828 -177.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 70.4 mt -139.54 158.94 43.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.835 1.254 . . . . 0.0 108.48 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -150.76 147.5 27.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.936 0.335 . . . . 0.0 111.569 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -122.81 169.27 11.28 Favored 'General case' 0 C--N 1.338 0.073 0 C-N-CA 124.867 1.267 . . . . 0.0 112.633 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -76.42 -8.24 56.72 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.887 0.475 . . . . 0.0 110.861 -176.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.9 t -156.26 158.44 37.52 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 121.708 -0.62 . . . . 0.0 111.165 -178.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.01 -30.01 67.22 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.384 0.273 . . . . 0.0 111.192 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 71.8 m -79.34 -26.33 42.14 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 110.483 -0.192 . . . . 0.0 110.483 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -72.52 -30.98 64.97 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 121.042 0.449 . . . . 0.0 111.355 174.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.92 -28.04 55.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.864 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 51.6 tp -79.93 -35.2 38.11 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.439 0.296 . . . . 0.0 111.455 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -74.41 -38.35 63.1 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.725 -0.609 . . . . 0.0 109.414 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.263 0.3 OUTLIER -72.45 -21.41 61.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 175.38 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.64 -36.05 78.08 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 170.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.42 -43.96 95.99 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.253 6.6 m-85 -85.64 -18.63 32.69 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -106.56 -12.76 15.51 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.935 0.789 . . . . 0.0 112.396 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -74.98 141.05 44.03 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.239 0.927 . . . . 0.0 109.269 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 55.07 19.24 2.67 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.294 1.037 . . . . 0.0 112.636 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.253 39.9 t80 -73.24 139.2 46.05 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -72.5 125.42 27.39 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 122.309 0.243 . . . . 0.0 110.868 -176.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 564' ' ' MET . . . . . 0.413 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 75.3 mtm -83.52 152.69 24.78 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.686 0.395 . . . . 0.0 111.926 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.424 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 N--CA 1.455 -0.191 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.0 160.12 43.53 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.948 3.099 . . . . 0.0 111.717 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -129.92 142.39 50.66 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 102.677 -3.083 . . . . 0.0 102.677 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.258 0.7 OUTLIER -77.37 138.37 39.27 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 179.078 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.3 tt -83.14 151.85 25.54 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.42 150.42 47.63 Favored 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.546 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -157.25 165.15 36.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 111.184 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 28.8 p -158.99 170.37 22.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.45 0.7 . . . . 0.0 109.713 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -56.48 125.71 23.26 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 177.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.1 t -86.64 152.42 22.59 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -169.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -111.7 10.13 20.98 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.34 14.18 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 124.046 0.938 . . . . 0.0 111.836 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.8 mm-40 -92.01 -3.92 55.19 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.98 178.36 3.44 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.636 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.76 32.01 1.43 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.349 0.26 . . . . 0.0 111.63 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.43 -1.271 . . . . 0.0 110.701 -178.959 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 N--CA 1.454 -0.837 0 N-CA-C 109.825 -0.875 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 375' ' ' HIS . . . . . 0.401 ' HA ' ' HA2' ' A' ' 426' ' ' GLY . 41.1 p-80 -154.63 157.91 38.9 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.321 0.581 . . . . 0.0 112.182 -178.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.64 166.24 23.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.95 0.9 . . . . 0.0 111.391 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.22 -8.28 53.89 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -159.49 147.35 13.28 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 122.725 0.41 . . . . 0.0 110.985 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -13.75 36.16 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 123.565 2.843 . . . . 0.0 110.965 173.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -86.22 146.43 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -134.88 155.04 51.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.5 1.12 . . . . 0.0 108.488 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.31 134.83 34.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -174.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.07 150.46 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.097 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -139.96 176.31 8.85 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 105.254 -2.128 . . . . 0.0 105.254 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 81.74 11.84 82.31 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 116.417 -0.356 . . . . 0.0 112.426 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 62.7 mt -79.29 22.76 0.41 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.652 0.726 . . . . 0.0 112.131 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -65.17 -25.64 67.82 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -175.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.439 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.1 pm0 -66.92 157.06 34.19 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.395 0.617 . . . . 0.0 111.599 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 81.6 p -79.05 27.39 0.24 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.75 1.22 . . . . 0.0 112.23 -172.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.87 4.23 4.15 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.294 0.638 . . . . 0.0 112.696 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 39.9 mmm -102.37 141.89 34.46 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.729 0.3 . . . . 0.0 110.201 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -154.27 152.64 30.53 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.211 0.604 . . . . 0.0 109.47 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -57.68 -37.07 72.83 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -71.3 -38.47 71.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.247 0.476 . . . . 0.0 112.184 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -76.02 -45.58 33.76 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.147 0.579 . . . . 0.0 112.233 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.61 -42.36 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -75.91 -29.93 58.59 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.764 -170.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 398' ' ' ASN . . . . . 0.4 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 2.0 p30 -76.97 -30.88 56.18 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.893 1.224 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.54 -55.75 19.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 N-CA-C 106.405 -1.702 . . . . 0.0 106.405 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.541 5.4 p90 -76.6 -4.91 45.41 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 173.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 49.9 t -74.63 -30.52 61.68 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.924 -0.485 . . . . 0.0 110.624 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.0 pp -62.34 -16.3 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.301 -0.559 . . . . 0.0 111.152 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -87.53 -7.33 57.7 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.55 -172.28 44.84 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.226 -178.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -85.03 121.04 27.23 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.082 0.553 . . . . 0.0 109.816 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.5 9.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -130.16 -59.92 1.03 Allowed 'General case' 0 C--N 1.339 0.144 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -144.14 169.77 17.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.859 1.208 . . . . 0.0 112.51 -177.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.0 p -147.24 144.13 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 125.057 1.343 . . . . 0.0 108.24 175.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -154.39 124.16 6.67 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 117.961 0.346 . . . . 0.0 111.438 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.263 5.9 m-85 -72.68 155.24 40.2 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 35.9 mmt -84.92 128.73 34.75 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.271 0.629 . . . . 0.0 111.64 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -18.29 53.29 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 84.1 p -101.95 1.59 36.91 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -126.89 152.03 74.74 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 118.342 0.519 . . . . 0.0 110.623 -175.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.0 -15.6 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.535 2.823 . . . . 0.0 111.441 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.63 94.96 0.1 OUTLIER Glycine 0 C--N 1.338 0.66 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.54 160.0 31.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.651 0.78 . . . . 0.0 109.208 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.15 144.67 14.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 77.6 mtp -84.7 154.2 22.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.712 0.805 . . . . 0.0 109.335 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 38.1 t -147.48 152.12 13.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -134.21 139.88 46.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.114 -0.366 . . . . 0.0 110.06 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.4 ptp -164.14 172.49 13.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.273 1.029 . . . . 0.0 110.047 -174.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.33 126.77 28.55 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.91 -34.03 66.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -169.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 426' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 375' ' ' HIS . . . -58.68 -85.79 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -178.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -64.15 -37.42 87.41 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.46 -35.96 17.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.401 -0.809 . . . . 0.0 112.876 -171.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.2 t -83.18 -28.29 7.87 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 CA-C-N 120.242 1.383 . . . . 0.0 109.153 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -68.71 -47.29 66.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.753 177.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -68.12 -36.87 80.43 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -176.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.69 77.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.944 0.793 . . . . 0.0 109.814 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 46.9 mt -76.48 -14.81 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 122.826 0.45 . . . . 0.0 110.85 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 55.4 m -97.24 -17.42 19.84 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -130.27 -26.13 2.37 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 116.29 1.959 . . . . 0.0 116.29 -169.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.61 -11.09 2.4 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 120.532 1.515 . . . . 0.0 114.27 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.633 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 36.5 p-10 -71.96 101.18 2.62 Favored 'General case' 0 C--O 1.198 -1.615 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 -168.091 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 7.4 m-80 77.19 21.47 1.08 Allowed 'General case' 0 N--CA 1.483 1.221 0 O-C-N 117.381 -3.325 . . . . 0.0 112.763 -163.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.21 159.67 28.4 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.536 -0.728 . . . . 0.0 110.002 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -74.33 136.79 42.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 115.675 1.731 . . . . 0.0 115.675 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -157.96 140.9 14.94 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.351 0.661 . . . . 0.0 109.531 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 59.44 17.5 6.03 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.73 10.22 85.42 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -174.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -132.39 -162.26 1.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.509 1.523 . . . . 0.0 108.31 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -135.36 146.97 48.91 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 122.646 0.378 . . . . 0.0 110.812 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.63 99.93 5.34 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 176.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -65.22 131.33 46.22 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 115.746 -2.073 . . . . 0.0 112.487 -171.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.633 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.449 2.1 t -125.91 152.13 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 112.62 -3.632 . . . . 0.0 115.809 168.414 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.8 t -162.96 171.26 16.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.778 1.231 . . . . 0.0 108.462 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.2 p -76.18 146.95 8.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.2 t -86.33 156.86 20.05 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.066 0.547 . . . . 0.0 111.01 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -92.55 -8.51 44.17 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 111.179 0.066 . . . . 0.0 111.179 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -77.49 150.43 79.55 Favored Pre-proline 0 CA--C 1.529 0.144 0 C-N-CA 123.458 0.703 . . . . 0.0 110.637 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.58 -32.95 1.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.411 2.74 . . . . 0.0 112.484 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.03 159.89 11.57 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.364 0.666 . . . . 0.0 110.343 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 39.1 mt -91.09 122.68 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 39.1 mmm -76.11 160.48 78.12 Favored Pre-proline 0 N--CA 1.456 -0.158 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 170.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -49.11 117.56 2.92 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.752 2.301 . . . . 0.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -78.49 135.44 15.83 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 -169.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -78.32 164.13 25.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 168.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 33.4 t -143.78 159.12 43.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.961 0.8 . . . . 0.0 112.966 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -143.91 2.98 1.22 Allowed 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -177.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.4 -178.83 53.33 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 123.332 0.491 . . . . 0.0 112.009 -176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.7 mt -143.53 158.7 43.45 Favored 'General case' 0 C--N 1.334 -0.099 0 C-N-CA 123.631 0.772 . . . . 0.0 109.109 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -68.73 -14.26 62.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.21 0.204 . . . . 0.0 111.428 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -120.43 27.25 8.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.694 0.798 . . . . 0.0 111.536 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -176.58 -154.46 11.83 Favored Glycine 0 C--N 1.337 0.613 0 O-C-N 121.549 -0.719 . . . . 0.0 111.35 -178.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -132.97 -11.43 2.96 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.0 t -127.08 156.03 42.36 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.036 0.534 . . . . 0.0 110.279 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.1 p -122.7 3.74 9.52 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.598 0.759 . . . . 0.0 112.304 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -142.92 141.73 31.55 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 124.818 1.247 . . . . 0.0 114.331 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -155.13 156.68 36.21 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.963 -0.46 . . . . 0.0 111.382 -177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -119.84 132.54 55.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.695 1.198 . . . . 0.0 112.943 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -122.25 3.39 9.79 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 98.0 p -68.9 -17.57 63.99 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.568 0.347 . . . . 0.0 111.299 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -113.96 -1.58 13.77 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.306 0.642 . . . . 0.0 111.594 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.3 t -75.22 146.98 40.72 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.405 0.282 . . . . 0.0 110.941 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -76.29 -17.37 59.48 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.455 0.302 . . . . 0.0 110.792 178.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -65.74 -23.62 66.78 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.486 0.315 . . . . 0.0 110.787 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -68.49 113.55 6.13 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' ARG . . . . . 0.582 HH11 ' HG2' ' A' ' 481' ' ' ARG . 6.8 ttt-85 -81.08 -29.96 34.82 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 116.818 -0.173 . . . . 0.0 111.409 -172.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -89.01 7.46 34.68 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.1 t -71.38 -18.93 62.33 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.19 149.93 71.39 Favored Pre-proline 0 C--O 1.232 0.137 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.13 -24.52 27.91 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.026 2.484 . . . . 0.0 111.681 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -81.35 -22.68 38.24 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.164 0.438 . . . . 0.0 110.9 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.56 -39.21 17.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 122.097 -0.377 . . . . 0.0 110.019 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -69.01 -20.47 64.15 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.116 0.566 . . . . 0.0 111.443 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.42 -16.96 60.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.068 -0.395 . . . . 0.0 111.732 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -124.09 31.64 5.76 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.118 0.567 . . . . 0.0 111.773 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.89 156.84 6.2 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.311 0.577 . . . . 0.0 112.034 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.23 97.58 3.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.5 mm -137.12 136.9 47.08 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.04 0 C-N-CA 122.845 0.458 . . . . 0.0 110.096 -174.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -152.09 173.42 14.93 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 110.21 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -57.28 156.58 14.69 Favored Pre-proline 0 CA--C 1.531 0.22 0 C-N-CA 123.454 0.702 . . . . 0.0 109.928 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.13 150.82 87.54 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 122.947 2.431 . . . . 0.0 110.007 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.0 t -155.07 166.54 33.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 -174.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -83.71 -0.91 52.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.656 0.382 . . . . 0.0 110.55 179.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -96.27 138.19 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 177.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.1 mt -123.14 155.01 37.87 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.07 0.548 . . . . 0.0 109.662 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -119.14 142.12 48.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -136.55 158.94 43.25 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 121.506 0.67 . . . . 0.0 110.2 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -150.9 168.76 23.52 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 104.181 -2.526 . . . . 0.0 104.181 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 57.54 57.51 4.29 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.864 0.465 . . . . 0.0 110.847 -174.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -135.54 110.54 10.45 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.356 0.262 . . . . 0.0 110.826 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.66 165.78 1.59 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 124.693 3.595 . . . . 0.0 113.162 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 16.4 mt -68.37 -16.46 63.93 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.006 -176.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.93 -10.6 50.07 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -81.61 -13.88 12.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -171.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.86 178.89 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -167.405 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.702 ' H ' HG22 ' A' ' 510' ' ' THR . 87.1 tt0 4.56 -64.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.541 1.936 . . . . 0.0 114.671 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.3 mt-10 -57.06 -43.0 81.62 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.9 -27.0 21.28 Favored 'General case' 0 C--N 1.35 0.6 0 CA-C-N 122.667 2.485 . . . . 0.0 105.712 -176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -60.12 -37.64 80.63 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.63 -1.228 . . . . 0.0 113.275 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.57 -49.67 52.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -79.61 -21.42 44.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.83 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 57.0 mt -71.93 -40.4 68.2 Favored 'Isoleucine or valine' 0 C--N 1.338 0.099 0 CA-C-N 119.006 0.821 . . . . 0.0 109.589 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 98.7 m -64.58 -33.99 77.2 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.688 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -63.29 -40.26 96.87 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -73.73 -9.34 58.56 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.655 0.382 . . . . 0.0 111.997 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 87.9 mt -107.86 -2.66 19.67 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.452 0.701 . . . . 0.0 111.606 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.08 -13.23 5.83 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.593 -0.56 . . . . 0.0 113.431 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 35.4 m -81.48 154.8 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.088 0 CA-C-N 118.191 0.996 . . . . 0.0 109.26 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -75.8 148.73 38.22 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.062 -0.399 . . . . 0.0 111.336 -176.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 53.3 ptt85 -70.79 156.23 92.28 Favored Pre-proline 0 CA--C 1.53 0.177 0 C-N-CA 123.277 0.631 . . . . 0.0 109.936 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.26 151.29 83.8 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.238 2.625 . . . . 0.0 110.959 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.5 t -87.11 -14.95 39.88 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 23.2 t -151.46 154.86 37.41 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 122.489 0.316 . . . . 0.0 110.639 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 57.8 t -143.62 146.38 21.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 C-N-CA 123.702 0.801 . . . . 0.0 110.187 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -147.26 141.61 26.33 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.488 0.715 . . . . 0.0 109.476 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -137.37 149.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.75 -172.44 4.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 92.0 p -140.83 -177.25 4.99 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.54 0.736 . . . . 0.0 110.628 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.6 -8.76 66.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 123.825 0.726 . . . . 0.0 112.142 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.51 -27.01 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.83 0.815 . . . . 0.0 111.017 177.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 80.2 p -165.07 165.75 19.72 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.414 0.686 . . . . 0.0 109.619 176.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.4 pm0 -96.85 -5.72 37.58 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.057 0.543 . . . . 0.0 110.915 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -77.61 -47.43 19.35 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 88.1 p -163.05 172.65 14.65 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.145 0.498 . . . . 0.0 110.929 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 42.1 t -77.41 167.3 21.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.336 0.589 . . . . 0.0 111.174 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 91.9 p -148.48 163.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.32 -165.87 36.55 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 119.772 -1.204 . . . . 0.0 113.485 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.88 159.23 25.94 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.809 0.844 . . . . 0.0 110.474 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.1 mt -137.71 155.39 49.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.953 1.301 . . . . 0.0 108.134 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -145.8 147.42 31.84 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 118.147 0.43 . . . . 0.0 111.498 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -124.67 171.08 10.35 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.929 1.292 . . . . 0.0 112.075 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -73.07 -12.22 60.83 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 47.4 t -157.52 164.48 37.32 Favored 'General case' 0 C--O 1.231 0.119 0 O-C-N 121.806 -0.559 . . . . 0.0 111.097 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -70.78 -29.2 65.33 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.477 0.311 . . . . 0.0 110.713 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 82.3 p -76.25 -26.34 55.89 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 178.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.35 -36.93 74.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.968 0.507 . . . . 0.0 111.476 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.53 -28.51 56.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.465 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 52.0 tp -74.03 -40.88 62.57 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.23 -0.294 . . . . 0.0 111.235 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.64 -36.81 73.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.622 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 2.5 m -70.31 -27.71 64.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 176.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -65.23 -39.27 92.51 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.04 -47.22 75.33 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -84.51 -27.09 27.64 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 27.6 tp -93.66 -20.0 20.59 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -69.99 149.88 47.26 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.315 0.507 . . . . 0.0 110.211 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 57.31 22.65 7.98 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.738 1.215 . . . . 0.0 113.122 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -65.44 134.75 54.14 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 177.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -76.61 121.08 22.7 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.476 0.31 . . . . 0.0 110.707 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 68.3 mtm -90.4 152.62 20.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 123.131 0.573 . . . . 0.0 109.969 172.472 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.67 164.51 35.47 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.298 2.665 . . . . 0.0 111.002 176.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -129.94 142.32 50.66 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 102.997 -2.964 . . . . 0.0 102.997 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.25 0.8 OUTLIER -84.96 140.3 31.18 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 115.321 1.601 . . . . 0.0 115.321 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.7 tt -78.26 147.14 34.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.28 147.97 52.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.401 -0.519 . . . . 0.0 110.619 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.26 164.01 38.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.234 0.54 . . . . 0.0 111.245 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 24.6 p -162.24 175.33 11.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.269 1.028 . . . . 0.0 110.038 -178.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -57.97 125.83 24.82 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.9 t -81.83 150.64 27.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -172.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.27 0.7 OUTLIER -114.54 10.3 16.82 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.852 1.426 . . . . 0.0 114.852 169.836 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.63 163.4 21.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.215 1.006 . . . . 0.0 111.906 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -96.95 -0.78 46.96 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.437 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -155.09 168.56 26.61 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.629 0.772 . . . . 0.0 110.293 -178.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.92 20.46 1.44 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.492 0.717 . . . . 0.0 110.381 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.457 -1.259 . . . . 0.0 110.765 -175.564 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.455 -0.785 0 N-CA-C 111.183 -0.353 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -155.2 158.54 39.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.165 0.586 . . . . 0.0 110.422 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.83 160.61 31.88 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.873 0.368 . . . . 0.0 111.237 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -73.98 -6.6 48.34 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.3 t -158.85 146.93 13.7 Favored Pre-proline 0 N--CA 1.456 -0.138 0 C-N-CA 122.759 0.424 . . . . 0.0 110.49 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -12.74 34.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.492 2.795 . . . . 0.0 110.742 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.51 148.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 C-N-CA 122.846 0.458 . . . . 0.0 112.182 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.9 tt -140.28 155.71 46.74 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 14.5 tpt -139.05 131.61 28.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.241 0.473 . . . . 0.0 110.811 -174.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.26 155.12 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.8 175.11 10.43 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -176.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.24 9.62 81.7 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.071 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.81 26.79 0.4 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.467 0.707 . . . . 0.0 112.461 -177.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.6 -40.74 97.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.462 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.43 148.61 51.62 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.122 0.487 . . . . 0.0 111.201 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 67.3 m -70.08 -8.02 46.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -72.93 -15.4 61.57 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 122.58 0.352 . . . . 0.0 111.455 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 51.6 mmm -90.72 148.0 22.88 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.924 0.392 . . . . 0.0 110.814 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -162.23 159.75 26.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.296 1.038 . . . . 0.0 108.284 175.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.9 p -59.92 -30.77 69.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -74.99 -37.04 61.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.048 0.386 . . . . 0.0 111.779 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -70.81 -51.5 26.37 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 122.726 0.41 . . . . 0.0 110.231 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 38.1 t -69.08 -43.03 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.138 0.575 . . . . 0.0 109.743 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.29 -29.48 57.41 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -73.79 -33.67 64.32 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 120.124 1.329 . . . . 0.0 109.839 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 399' ' ' VAL . . . . . 0.411 HG22 ' CD2' ' A' ' 556' ' ' LEU . 17.6 t -57.31 -57.06 11.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.272 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.558 2.8 p90 -76.49 -4.03 40.48 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 117.758 2.503 . . . . 0.0 117.758 175.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.37 -33.15 58.91 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.881 -0.512 . . . . 0.0 111.085 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -60.81 -14.86 24.4 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -84.51 -9.78 58.03 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.17 -151.71 15.35 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.354 0.525 . . . . 0.0 112.233 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -99.57 126.15 45.5 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.551 0.34 . . . . 0.0 110.961 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.02 165.47 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.86 -62.76 1.22 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -144.28 161.17 39.6 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -169.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.14 150.32 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.45 1.1 . . . . 0.0 109.162 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -157.47 132.42 8.76 Favored 'General case' 0 CA--C 1.527 0.096 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.8 m-85 -82.89 163.66 20.98 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -122.43 123.14 40.63 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 122.838 0.455 . . . . 0.0 111.959 -177.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.006 0.523 . . . . 0.0 111.254 169.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.9 p -77.91 -7.76 57.18 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.292 0.637 . . . . 0.0 112.432 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -132.13 159.47 72.04 Favored Pre-proline 0 CA--C 1.529 0.147 0 C-N-CA 124.131 0.973 . . . . 0.0 109.319 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -16.43 54.87 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.92 2.413 . . . . 0.0 111.013 177.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 173.5 101.16 0.14 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.25 158.55 39.01 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.428 0.691 . . . . 0.0 109.75 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.19 153.88 29.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.008 0.433 . . . . 0.0 110.985 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.3 ttm -107.39 151.19 25.84 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.024 0.929 . . . . 0.0 108.749 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.7 t -136.83 152.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 123.299 0.639 . . . . 0.0 111.599 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -132.12 128.93 39.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.2 mtp -152.53 171.11 18.62 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -170.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.445 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.92 125.65 26.61 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 169.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -73.31 -29.63 62.83 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -63.94 -83.65 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 -178.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -72.66 -36.48 67.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.72 -33.32 18.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 119.944 1.247 . . . . 0.0 114.151 -169.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 52.5 t -88.88 -24.49 6.0 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.13 1.332 . . . . 0.0 109.858 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -70.84 -50.83 31.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -65.11 -35.21 80.4 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.36 77.55 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.576 0.625 . . . . 0.0 110.552 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 72.6 mt -79.91 -9.1 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.088 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 26.0 m -98.85 -20.18 16.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.17 -29.52 2.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -169.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.06 -13.09 7.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.623 1.556 . . . . 0.0 113.56 -173.012 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.7 p-10 -71.62 100.79 2.36 Favored 'General case' 0 C--O 1.201 -1.46 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -167.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.3 m-80 76.65 22.04 1.21 Allowed 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 123.666 2.939 . . . . 0.0 113.207 -162.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -79.25 163.19 25.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.494 -0.754 . . . . 0.0 109.425 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.39 135.94 36.27 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.6 ttt -157.67 142.61 16.7 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 59.55 18.5 7.07 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 116.53 2.048 . . . . 0.0 116.53 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.31 11.38 85.39 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 -174.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -134.51 -162.86 1.3 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.439 1.496 . . . . 0.0 108.474 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -136.86 149.72 47.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.95 0.405 . . . . 0.0 111.023 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 13.9 ptm -127.45 83.59 2.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.116 0.966 . . . . 0.0 108.873 178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -55.92 127.96 32.83 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-O 115.759 -2.067 . . . . 0.0 112.21 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.43 2.0 t -128.54 152.66 36.98 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 113.48 -3.288 . . . . 0.0 116.51 169.208 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -160.3 167.44 27.49 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.375 1.47 . . . . 0.0 107.974 177.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.23 146.4 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.5 t -83.03 166.02 19.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.827 0.451 . . . . 0.0 111.253 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.16 12.48 7.12 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -85.33 151.85 57.1 Favored Pre-proline 0 N--CA 1.456 -0.151 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.05 -36.56 4.21 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.789 2.326 . . . . 0.0 112.506 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.89 158.78 7.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.764 0.425 . . . . 0.0 111.42 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -75.31 130.53 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.5 mmm -97.08 118.6 64.59 Favored Pre-proline 0 N--CA 1.454 -0.254 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.512 175.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.19 163.45 32.69 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.167 2.578 . . . . 0.0 109.772 175.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.52 -144.52 12.35 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -72.45 152.32 42.03 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.373 0.669 . . . . 0.0 109.83 -179.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 89.1 p -151.92 166.19 32.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.989 0.424 . . . . 0.0 111.439 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -84.63 -4.42 58.99 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.68 -177.69 51.35 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.7 mt -141.85 157.44 45.0 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.977 0.911 . . . . 0.0 108.996 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -75.37 -12.03 60.17 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.364 -0.21 . . . . 0.0 111.452 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -120.4 26.64 9.07 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.668 0.787 . . . . 0.0 110.122 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.92 -154.19 8.56 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -177.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 41.6 t -133.05 -26.11 1.74 Allowed 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.613 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 98.0 m -127.01 155.96 42.38 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.485 0.714 . . . . 0.0 110.338 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.4 p -75.93 -23.08 55.42 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -95.26 148.49 22.36 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -157.15 157.49 34.54 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.088 0.555 . . . . 0.0 109.901 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -134.35 153.19 52.03 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -128.01 2.67 5.9 Favored 'General case' 0 CA--C 1.527 0.091 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.3 p -66.07 -17.73 64.88 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.6 0.36 . . . . 0.0 111.762 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.05 2.07 14.83 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.405 0.682 . . . . 0.0 111.321 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 39.9 t -82.33 -7.85 59.63 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.962 0.505 . . . . 0.0 112.014 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 62.4 -7.96 0.12 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.126 1.37 . . . . 0.0 113.155 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -65.56 -15.8 63.07 Favored 'General case' 0 C--O 1.231 0.093 0 O-C-N 121.685 -0.635 . . . . 0.0 112.581 -178.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -55.56 125.34 20.61 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -72.97 -33.77 66.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -169.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.376 57.1 m-85 -98.19 8.15 45.22 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 117.946 2.573 . . . . 0.0 117.946 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.7 t -76.16 -13.78 60.18 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -132.44 149.56 73.46 Favored Pre-proline 0 C--O 1.231 0.087 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -71.58 -23.87 22.7 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.28 2.653 . . . . 0.0 111.624 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.56 -25.34 53.95 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.133 0.424 . . . . 0.0 110.317 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -86.68 -48.29 8.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -65.18 -19.53 66.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.476 0.71 . . . . 0.0 112.765 -171.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.62 -29.22 62.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.243 0.474 . . . . 0.0 111.388 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -124.06 10.25 8.77 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -60.46 154.51 20.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.663 0.665 . . . . 0.0 112.719 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -155.34 138.71 15.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 47.2 mt -142.12 142.74 27.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 C-N-CA 123.449 0.7 . . . . 0.0 109.511 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -148.27 173.39 13.07 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 123.801 0.841 . . . . 0.0 110.336 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -58.73 153.9 39.21 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.296 0.638 . . . . 0.0 110.049 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.22 147.44 88.07 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 123.087 2.525 . . . . 0.0 110.267 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.4 t -152.67 174.49 13.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.388 0.675 . . . . 0.0 109.771 -174.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -83.68 -0.64 51.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -178.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -99.71 136.45 30.9 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 552' ' ' ALA . 4.6 mm? -121.14 156.23 32.79 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.805 0.842 . . . . 0.0 109.644 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -127.1 142.35 51.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -136.6 158.95 43.24 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.305 0.574 . . . . 0.0 111.257 -176.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -150.16 164.49 35.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.403 -2.814 . . . . 0.0 103.403 -177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 34.0 m120 58.53 56.79 4.11 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.949 0.5 . . . . 0.0 111.104 -172.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -122.02 151.94 59.06 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.724 0.41 . . . . 0.0 111.174 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.57 154.26 37.45 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.467 2.778 . . . . 0.0 112.118 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.78 -16.55 63.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.98 0.512 . . . . 0.0 111.675 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -122.83 27.71 7.6 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 123.701 0.8 . . . . 0.0 110.968 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.8 p -63.64 -17.01 19.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.54 -177.91 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -164.902 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 22.7 pt-20 -21.34 -41.77 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.794 1.638 . . . . 0.0 115.215 -169.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.6 -47.2 82.81 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 172.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -86.3 -27.01 24.62 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 121.709 2.049 . . . . 0.0 106.631 -173.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -67.12 -36.26 81.52 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -76.84 -38.65 53.38 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -73.58 -28.66 61.96 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.398 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.66 -44.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 O-C-N 121.966 -0.459 . . . . 0.0 110.969 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 31.2 p -69.12 -25.44 64.4 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.183 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.96 -42.46 85.16 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -70.41 -18.3 63.02 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 70.8 mt -96.07 -6.01 39.62 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.653 0.381 . . . . 0.0 111.415 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.59 -11.87 3.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.875 0.75 . . . . 0.0 113.769 177.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 24.1 m -77.79 159.37 4.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 118.194 0.997 . . . . 0.0 110.45 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -68.9 153.68 43.36 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.113 0.482 . . . . 0.0 111.627 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -76.08 157.03 83.76 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.48 0.712 . . . . 0.0 110.692 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.26 160.09 51.2 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.343 2.696 . . . . 0.0 111.015 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -95.25 -15.75 22.98 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.1 t -154.22 159.99 41.61 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 122.793 0.437 . . . . 0.0 110.313 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.29 150.08 12.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -145.6 141.06 27.83 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 124.0 0.92 . . . . 0.0 109.071 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 25.0 t -139.9 141.46 34.12 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 C-N-CA 123.524 0.729 . . . . 0.0 110.023 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.67 167.23 29.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 -177.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 36.7 t -89.76 170.72 10.19 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.654 0.782 . . . . 0.0 110.763 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 92.27 -178.07 39.9 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 123.751 0.691 . . . . 0.0 112.048 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 41.0 mttm 62.53 -12.08 0.07 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.083 1.753 . . . . 0.0 113.698 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 44.5 t -165.6 162.02 18.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.451 0.701 . . . . 0.0 110.466 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -116.95 -5.78 11.46 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.376 0.67 . . . . 0.0 110.104 174.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -91.98 -31.32 15.66 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.747 0.819 . . . . 0.0 112.275 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.7 p -159.11 168.92 25.4 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 121.089 0.471 . . . . 0.0 111.563 -171.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 32.9 t -89.5 170.93 10.09 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.847 0.859 . . . . 0.0 110.97 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.5 t -148.65 159.87 43.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.245 1.018 . . . . 0.0 109.186 178.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.71 -171.79 44.42 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.001 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 159.8 27.05 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.813 0.845 . . . . 0.0 110.441 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.0 mt -140.87 159.22 42.68 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.675 1.19 . . . . 0.0 108.859 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -150.32 148.74 29.2 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 122.102 -0.374 . . . . 0.0 111.745 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -126.72 171.36 11.25 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.106 1.362 . . . . 0.0 112.075 178.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -74.59 -10.41 59.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.59 0.356 . . . . 0.0 110.567 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.2 t -157.66 157.13 32.99 Favored 'General case' 0 C--O 1.231 0.123 0 O-C-N 121.698 -0.626 . . . . 0.0 110.444 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -75.04 -19.69 59.91 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.019 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.1 m -80.84 -29.45 35.86 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 118.188 0.449 . . . . 0.0 110.181 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.99 -36.47 72.49 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 121.41 0.624 . . . . 0.0 111.219 171.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 552' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 500' ' ' LEU . . . -72.22 -27.01 62.26 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.663 177.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.2 tp -79.82 -45.22 19.13 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.596 0.358 . . . . 0.0 111.539 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.5 -33.46 75.97 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -73.81 -28.15 61.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 175.304 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 556' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' A' ' 399' ' ' VAL . 1.8 tt -70.38 -35.18 73.34 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 171.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -57.36 -49.45 72.74 Favored Glycine 0 C--N 1.335 0.519 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.305 35.1 m-85 -84.07 -11.78 56.16 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.395 2.739 . . . . 0.0 118.395 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.15 -20.68 14.07 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.823 0.738 . . . . 0.0 112.859 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -70.64 139.39 51.31 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 119.315 0.962 . . . . 0.0 109.532 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.2 t60 55.96 17.12 2.43 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.031 1.332 . . . . 0.0 113.444 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 32.7 t80 -72.68 139.4 47.25 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -69.7 140.76 53.57 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.958 -0.464 . . . . 0.0 112.193 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.4 mtm -83.57 152.66 24.74 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.921 0.391 . . . . 0.0 111.362 175.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 172.176 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.82 159.17 48.94 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.381 2.721 . . . . 0.0 111.196 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -130.01 142.32 50.64 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 102.731 -3.062 . . . . 0.0 102.731 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.263 0.6 OUTLIER -76.55 141.46 41.17 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 -176.271 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.41 138.15 32.99 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.3 1.44 . . . . 0.0 107.658 173.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 150.08 51.71 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 118.091 0.405 . . . . 0.0 110.308 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.25 162.79 40.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.173 0.511 . . . . 0.0 111.247 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.6 p -158.57 167.6 29.16 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.823 0.849 . . . . 0.0 110.378 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -56.0 122.91 12.69 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.1 t -80.12 153.38 28.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -169.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 t -119.05 12.43 12.73 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.16 0.984 . . . . 0.0 113.434 169.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.03 20.19 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.138 0.975 . . . . 0.0 111.88 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -92.62 -3.49 54.88 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.571 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -153.9 171.49 18.9 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.75 0.82 . . . . 0.0 110.436 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.63 24.91 0.97 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.471 0.708 . . . . 0.0 110.198 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.604 -1.188 . . . . 0.0 110.439 -176.629 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 N--CA 1.454 -0.834 0 CA-C-O 121.09 0.371 . . . . 0.0 112.724 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -150.17 155.71 40.27 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.016 0.526 . . . . 0.0 110.569 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.83 161.15 29.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -76.61 -8.83 58.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.771 0.428 . . . . 0.0 110.272 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -157.29 147.77 16.03 Favored Pre-proline 0 CA--C 1.527 0.086 0 O-C-N 121.7 -0.625 . . . . 0.0 110.74 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.91 -17.21 46.57 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.239 2.626 . . . . 0.0 110.539 173.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.1 151.49 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -141.38 155.12 45.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.676 1.19 . . . . 0.0 108.338 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 43.9 tpp -136.63 137.52 40.19 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.343 0.257 . . . . 0.0 110.827 -176.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -131.69 150.91 34.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -138.04 175.69 9.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 12.34 77.73 Favored Glycine 0 CA--C 1.528 0.892 0 N-CA-C 112.014 -0.434 . . . . 0.0 112.014 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.22 25.95 0.57 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.343 0.657 . . . . 0.0 111.655 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -64.86 -40.21 94.79 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -176.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 388' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.1 pm0 -67.94 147.85 51.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.0 0.429 . . . . 0.0 110.582 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 49.9 m -70.54 -8.47 51.64 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -72.95 -17.19 61.5 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.124 0.42 . . . . 0.0 111.42 178.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 66.3 mmm -85.18 148.14 26.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.088 0.403 . . . . 0.0 110.588 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.38 155.52 22.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.9 p -61.29 -30.56 70.56 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -72.45 -39.46 67.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.763 0.316 . . . . 0.0 110.559 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -76.06 -41.18 51.48 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 t -71.06 -43.65 75.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -75.1 -30.01 60.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 398' ' ' ASN . . . . . 0.409 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.4 p30 -78.23 -28.31 47.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.018 1.281 . . . . 0.0 110.234 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 399' ' ' VAL . . . . . 0.49 HG22 HD12 ' A' ' 556' ' ' LEU . 2.4 t -59.53 -57.02 13.43 Favored 'Isoleucine or valine' 0 C--N 1.341 0.222 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -178.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.551 1.6 p90 -76.65 -5.71 49.03 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 401' ' ' CYS . . . . . 0.409 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 48.7 t -71.37 -32.27 68.29 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 117.973 0.351 . . . . 0.0 110.609 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -62.59 -14.99 48.97 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 120.321 -0.551 . . . . 0.0 111.279 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -90.5 -2.16 57.91 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 117.811 2.523 . . . . 0.0 117.811 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.0 -170.16 40.59 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.748 0.703 . . . . 0.0 113.054 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -83.07 132.62 35.11 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.54 -0.388 . . . . 0.0 110.797 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.94 165.53 8.82 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.096 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -177.035 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -122.49 -68.83 0.86 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.423 0.289 . . . . 0.0 111.522 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -154.54 174.44 14.93 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.219 0.463 . . . . 0.0 112.091 -177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.47 149.94 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 C-N-CA 124.426 1.09 . . . . 0.0 109.531 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -155.27 130.21 9.38 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.854 0.461 . . . . 0.0 111.314 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.279 3.7 m-85 -80.98 152.09 28.15 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 178.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 412' ' ' MET . . . . . 0.461 ' HE3' ' HG3' ' A' ' 420' ' ' MET . 34.7 mmt -73.5 134.17 43.8 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-O 121.111 0.481 . . . . 0.0 111.808 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -79.21 -33.96 43.29 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.898 0.879 . . . . 0.0 111.974 178.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 70.7 m -102.05 -17.91 15.85 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -174.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -91.74 150.27 40.59 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 118.445 0.566 . . . . 0.0 110.562 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.18 -12.81 23.42 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.668 2.912 . . . . 0.0 112.432 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.82 81.42 0.06 OUTLIER Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.334 -0.706 . . . . 0.0 111.334 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.69 161.34 39.85 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.062 0.545 . . . . 0.0 109.87 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.95 149.28 19.54 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 420' ' ' MET . . . . . 0.461 ' HG3' ' HE3' ' A' ' 412' ' ' MET . 78.5 mtp -93.6 151.51 19.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.973 0.909 . . . . 0.0 109.588 172.152 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.0 t -143.9 154.24 15.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -138.71 133.79 32.72 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 28.1 mtm -153.24 175.59 12.9 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 124.238 1.015 . . . . 0.0 109.5 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 424' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.45 123.57 19.56 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 172.028 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -72.43 -32.41 66.3 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -167.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.83 -89.39 0.01 OUTLIER Glycine 0 C--N 1.339 0.705 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -71.68 -29.12 64.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.47 -35.15 18.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.765 -172.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 55.8 t -89.3 -26.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 118.319 -1.352 . . . . 0.0 109.447 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -68.56 -49.27 60.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.064 175.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -70.41 -31.37 68.54 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.66 78.31 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.876 0.762 . . . . 0.0 110.213 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.04 -15.59 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.121 0.569 . . . . 0.0 110.882 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.7 m -91.01 -20.66 21.86 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -123.46 -29.55 3.77 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 -169.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.0 mt -134.42 -5.53 2.59 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -171.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 437' ' ' ASN . . . . . 0.64 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.3 p-10 -71.65 100.99 2.42 Favored 'General case' 0 C--O 1.204 -1.341 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -169.225 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 438' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.9 m-80 77.21 22.06 1.02 Allowed 'General case' 0 N--CA 1.483 1.216 0 O-C-N 117.713 -3.117 . . . . 0.0 113.019 -160.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -83.08 156.96 23.04 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.946 -1.096 . . . . 0.0 109.752 167.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.252 21.8 m-85 -74.71 142.59 44.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 28.2 ttt -161.51 140.16 9.66 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.433 0.693 . . . . 0.0 109.901 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.386 47.7 m-85 56.83 27.21 12.57 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 117.77 2.508 . . . . 0.0 117.77 -179.476 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.7 7.56 88.12 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -133.71 -163.49 1.37 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.953 1.301 . . . . 0.0 108.211 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -138.88 146.33 41.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.29 107.31 10.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 447' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 3.6 m-20 -69.35 133.92 48.42 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 115.653 -2.118 . . . . 0.0 111.813 -171.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 448' ' ' VAL . . . . . 0.64 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.465 2.0 t -125.11 151.18 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 113.191 -3.404 . . . . 0.0 115.132 168.44 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.7 t -161.48 165.98 27.85 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.807 1.243 . . . . 0.0 108.269 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.1 p -70.98 148.32 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.9 t -85.52 159.79 19.82 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.963 0.505 . . . . 0.0 110.969 177.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -105.13 0.02 27.04 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 121.948 0.099 . . . . 0.0 111.144 177.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -82.16 149.68 62.9 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.46 0.704 . . . . 0.0 110.507 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.02 -34.27 2.31 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.225 2.617 . . . . 0.0 112.148 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.11 158.75 12.43 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.366 0.666 . . . . 0.0 110.452 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.7 mt -85.09 135.86 23.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 174.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 60.4 mmm -98.8 156.69 35.3 Favored Pre-proline 0 N--CA 1.454 -0.258 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.021 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.24 118.69 5.11 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.883 2.388 . . . . 0.0 110.418 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -84.77 142.8 20.3 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 -176.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -77.74 125.6 29.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.6 p -77.79 153.39 32.89 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.864 0.364 . . . . 0.0 111.194 -176.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -139.83 -5.82 1.32 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.87 118.32 0.24 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.278 0.942 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.3 mt -77.36 160.22 28.94 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -69.3 -15.42 63.34 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 122.126 -0.359 . . . . 0.0 111.671 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -120.47 24.9 10.11 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.29 0.636 . . . . 0.0 110.186 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.94 -160.31 12.24 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 121.698 -0.626 . . . . 0.0 111.698 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 71.9 m -132.97 -5.54 3.11 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 95.1 m -127.03 155.67 42.86 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.162 0.585 . . . . 0.0 110.778 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.1 m -121.23 4.34 10.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.165 0.586 . . . . 0.0 110.34 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -144.82 147.77 33.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.517 1.127 . . . . 0.0 112.619 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -154.15 154.25 33.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.189 0.449 . . . . 0.0 111.374 -177.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -128.41 139.83 52.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.216 1.006 . . . . 0.0 113.387 -177.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -126.59 5.46 6.81 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 40.9 t -64.26 -27.03 68.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.713 0.405 . . . . 0.0 111.663 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -100.85 -1.36 34.92 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 122.918 0.487 . . . . 0.0 111.601 178.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.9 t -81.56 149.57 28.59 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.125 -0.36 . . . . 0.0 111.457 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -87.5 -4.94 58.99 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.215 0.606 . . . . 0.0 111.208 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -63.34 -19.15 64.37 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -62.18 109.15 1.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.199 0.6 . . . . 0.0 109.606 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -73.99 -29.27 61.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.305 69.7 m-85 -97.98 15.14 24.95 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.3 t -74.22 -14.76 60.98 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -131.06 148.37 70.0 Favored Pre-proline 0 C--O 1.233 0.214 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -177.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -72.27 -26.25 17.77 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.278 2.652 . . . . 0.0 112.063 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -79.09 -27.93 43.02 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.495 0.589 . . . . 0.0 110.007 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -77.28 -43.97 31.39 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 175.021 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.48 -19.24 63.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.69 -18.1 42.13 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 -1.48 8.26 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.28 162.05 15.5 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.257 0.551 . . . . 0.0 111.673 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.16 140.98 27.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.562 0.745 . . . . 0.0 109.75 178.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 33.5 mm -143.8 138.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -149.55 173.38 13.68 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.512 0.725 . . . . 0.0 110.361 -177.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -58.74 155.06 32.7 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -64.54 151.79 84.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.839 2.359 . . . . 0.0 109.351 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -154.51 169.17 24.43 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.793 0.437 . . . . 0.0 110.042 -174.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -83.77 -8.03 59.33 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.92 145.18 8.6 Favored 'Isoleucine or valine' 0 C--N 1.339 0.112 0 C-N-CA 123.34 0.656 . . . . 0.0 111.887 173.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.0 tp -138.05 153.16 49.36 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -126.95 148.38 50.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.678 0.791 . . . . 0.0 109.103 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -144.53 160.77 40.58 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.555 0.693 . . . . 0.0 109.746 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -152.75 164.9 36.9 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 104.01 -2.589 . . . . 0.0 104.01 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 59.11 57.6 3.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.919 0.488 . . . . 0.0 111.971 -173.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.44 153.52 53.85 Favored Pre-proline 0 CA--C 1.532 0.268 0 C-N-CA 123.042 0.537 . . . . 0.0 110.454 177.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.07 159.19 54.11 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.373 2.049 . . . . 0.0 110.229 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.46 -16.53 63.93 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.603 0.361 . . . . 0.0 111.498 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -109.27 19.04 19.86 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.248 0.619 . . . . 0.0 111.449 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 3.8 p -63.26 -18.91 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.079 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -175.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.607 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.86 -177.38 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 117.852 -1.07 . . . . 0.0 113.772 -165.541 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 511' ' ' GLU . . . . . 0.607 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -25.92 -37.9 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -169.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.2 mt-10 -58.21 -48.08 81.48 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 117.142 -1.409 . . . . 0.0 114.451 171.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -86.63 -27.14 24.0 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 122.529 2.422 . . . . 0.0 106.686 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -65.09 -38.59 91.2 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 176.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -74.88 -37.84 62.04 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -80.43 -22.05 41.57 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.542 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 50.3 mt -76.38 -43.89 35.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.418 0.554 . . . . 0.0 110.671 177.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 29.3 p -69.28 -33.92 73.95 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.729 0.695 . . . . 0.0 110.307 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -72.46 -26.2 61.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.2 tp10 -75.27 -26.71 58.99 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.284 0.234 . . . . 0.0 110.626 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -95.96 -2.9 46.11 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.231 0.613 . . . . 0.0 111.738 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 77.06 -1.19 64.45 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 123.416 0.532 . . . . 0.0 112.832 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.92 151.6 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 CA-C-N 117.995 0.897 . . . . 0.0 111.74 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -67.15 150.18 49.49 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.017 0.437 . . . . 0.0 110.38 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -76.98 152.61 82.54 Favored Pre-proline 0 CA--C 1.531 0.221 0 C-N-CA 123.012 0.525 . . . . 0.0 110.716 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.93 156.85 61.88 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.533 2.822 . . . . 0.0 110.631 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -89.71 -18.09 27.06 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 37.8 t -154.64 160.64 41.55 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 120.494 0.188 . . . . 0.0 110.842 176.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.81 146.54 9.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -177.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -147.23 141.13 25.86 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.051 0.941 . . . . 0.0 109.068 172.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.77 151.86 28.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -155.81 177.24 11.62 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 38.0 t -141.95 165.54 27.17 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.566 0.746 . . . . 0.0 109.859 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 123.96 -19.46 7.35 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.679 0.657 . . . . 0.0 111.636 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -80.24 -23.92 40.53 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.645 0.722 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 47.6 t -164.86 157.46 16.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.764 0.826 . . . . 0.0 109.487 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -97.0 -4.71 39.29 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.431 0.292 . . . . 0.0 110.257 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -78.13 -36.53 47.75 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.9 p -161.11 167.69 25.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.436 0.636 . . . . 0.0 112.325 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 48.4 t -85.56 164.99 17.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.223 1.009 . . . . 0.0 110.738 176.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 93.6 p -150.21 162.44 40.47 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.217 1.007 . . . . 0.0 108.414 177.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.94 -169.01 42.15 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.663 -178.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -121.12 160.23 24.15 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.978 0.911 . . . . 0.0 110.423 -177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.6 mt -142.12 163.97 31.43 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.14 1.376 . . . . 0.0 109.047 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -153.69 147.28 25.1 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.331 -0.231 . . . . 0.0 111.33 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.4 m-90 -126.15 172.53 9.95 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.164 1.386 . . . . 0.0 112.33 177.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -73.5 -7.78 53.22 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 39.9 t -159.64 162.05 35.11 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 122.963 0.505 . . . . 0.0 110.674 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -69.29 -30.94 69.14 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.346 -0.221 . . . . 0.0 110.55 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.6 m -75.65 -23.36 56.3 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 122.087 0.155 . . . . 0.0 110.784 178.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -74.09 -36.36 64.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.016 0.436 . . . . 0.0 111.66 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.04 -26.39 56.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.292 176.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.9 tp -78.46 -37.55 43.22 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.367 0.267 . . . . 0.0 111.421 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -72.68 -38.25 67.64 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.16 -27.14 63.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 175.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 556' ' ' LEU . . . . . 0.541 ' C ' HD13 ' A' ' 556' ' ' LEU . 1.1 tm? -66.94 -41.73 86.46 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.17 -31.63 79.64 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 119.691 -0.505 . . . . 0.0 112.307 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.273 6.2 m-85 -94.52 -10.0 33.57 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 177.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 89.6 mt -119.86 -8.94 9.78 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -70.48 139.15 51.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.516 1.053 . . . . 0.0 109.289 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.1 t60 58.75 17.83 5.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.997 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 29.2 t80 -68.89 138.34 54.59 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -74.0 136.6 43.19 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.782 -0.574 . . . . 0.0 112.29 -174.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.0 mtm -83.64 152.69 24.66 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.026 0.53 . . . . 0.0 111.79 175.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 170.477 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.0 p90 . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.39 167.23 27.82 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.589 2.859 . . . . 0.0 110.71 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -129.96 142.38 50.65 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 102.178 -3.267 . . . . 0.0 102.178 175.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.285 0.6 OUTLIER -82.42 138.48 34.41 Favored 'General case' 0 C--O 1.23 0.062 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -173.79 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 575' ' ' LEU . . . . . 0.406 HD13 ' C ' ' A' ' 575' ' ' LEU . 1.3 tm? -81.17 137.52 35.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.279 1.431 . . . . 0.0 107.694 172.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.89 147.47 52.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.46 161.1 40.08 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.946 0.403 . . . . 0.0 111.083 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.73 173.68 12.57 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.8 0.84 . . . . 0.0 110.33 -177.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -53.98 124.5 15.69 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 36.6 t -77.02 153.4 34.5 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 -171.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.261 1.0 OUTLIER -123.62 9.07 8.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.719 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.96 163.87 16.29 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.494 0.718 . . . . 0.0 110.704 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -82.83 0.58 43.31 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.41 165.37 1.4 Allowed 'General case' 0 C--O 1.23 0.029 0 C-N-CA 124.536 1.134 . . . . 0.0 110.196 175.295 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -84.29 -6.68 59.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.394 -1.289 . . . . 0.0 111.294 -179.483 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.306 35.1 t80 . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -73.77 167.86 54.29 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -71.38 176.19 8.32 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.617 3.545 . . . . 0.0 110.978 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -145.4 157.94 43.93 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.917 0.487 . . . . 0.0 110.851 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.75 156.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -76.37 0.88 17.93 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -157.43 146.72 15.0 Favored Pre-proline 0 CA--C 1.53 0.18 0 C-N-CA 122.741 0.417 . . . . 0.0 110.699 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.74 -10.7 29.85 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 123.239 2.626 . . . . 0.0 111.073 173.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.98 155.77 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.617 0.767 . . . . 0.0 112.386 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -137.98 154.4 49.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.333 1.053 . . . . 0.0 109.309 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 82.3 mmm -126.01 142.41 51.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 123.399 0.68 . . . . 0.0 111.836 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -136.24 148.69 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.443 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 10.7 m-85 -140.74 174.28 10.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 -175.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.55 10.11 82.24 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 45.3 mt -80.45 25.96 0.39 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.531 0.732 . . . . 0.0 112.239 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.51 -39.78 94.42 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -67.58 150.62 48.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.122 0.487 . . . . 0.0 111.217 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 87.6 p -69.06 -8.75 48.04 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -77.27 -17.06 58.69 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 117.92 0.327 . . . . 0.0 111.3 -176.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 65.4 mmm -88.29 145.43 25.85 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.943 0.338 . . . . 0.0 110.422 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -160.92 158.32 27.98 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.8 p -60.28 -30.93 69.78 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -174.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -70.4 -41.54 72.85 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 177.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.96 -42.47 48.34 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.52 -174.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -69.37 -43.01 81.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -176.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.28 -30.81 57.94 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.025 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -76.97 -30.77 56.12 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.914 1.234 . . . . 0.0 110.101 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.84 -55.76 21.84 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.559 1.3 p90 -76.51 -4.72 44.19 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 117.679 2.474 . . . . 0.0 117.679 173.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.1 t -72.74 -32.36 65.62 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 122.144 -0.347 . . . . 0.0 110.414 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.39 -17.19 52.97 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.49 177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -88.5 -4.53 58.59 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.99 176.03 33.65 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-N 118.605 0.639 . . . . 0.0 112.431 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.93 134.22 49.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 122.539 -0.389 . . . . 0.0 111.698 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.02 165.47 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 124.614 1.166 . . . . 0.0 113.65 -179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -121.49 -65.36 1.14 Allowed 'General case' 0 N--CA 1.457 -0.077 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.183 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -154.47 167.02 31.44 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.1 p -138.64 150.24 23.91 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 C-N-CA 124.031 0.933 . . . . 0.0 110.136 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -151.41 125.4 9.2 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.066 0.547 . . . . 0.0 110.988 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -85.3 157.65 20.51 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.3 ptp -136.39 135.64 38.94 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 121.948 0.88 . . . . 0.0 112.487 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 413' ' ' LYS . 11.8 ptmm? -79.13 -5.7 54.77 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 126.061 1.744 . . . . 0.0 112.769 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.8 t -77.76 -4.12 44.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.918 0.326 . . . . 0.0 111.823 -171.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.446 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 44.0 mmtm -141.74 157.36 65.02 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 124.159 0.983 . . . . 0.0 109.255 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.42 -11.91 33.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.177 2.585 . . . . 0.0 112.037 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.86 93.3 0.09 OUTLIER Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 175.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.5 162.78 39.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.788 0.435 . . . . 0.0 110.708 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.33 170.87 21.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.963 0.505 . . . . 0.0 110.243 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 21.6 ptm -131.97 152.23 51.24 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.695 0.798 . . . . 0.0 109.181 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.4 t -138.55 150.49 24.05 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.208 0 C-N-CA 123.184 0.594 . . . . 0.0 112.236 -173.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -129.06 131.09 47.27 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 46.0 mtp -152.87 174.89 13.52 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.588 0.755 . . . . 0.0 109.439 -170.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.468 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.66 115.5 7.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.5 p30 -72.24 -32.6 66.85 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -167.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.94 -86.47 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -74.65 -27.08 60.27 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 117.125 2.268 . . . . 0.0 117.125 -176.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.84 -35.2 17.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.074 -174.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.8 t -86.41 -27.21 6.07 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 CA-C-N 119.776 1.171 . . . . 0.0 108.818 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -66.19 -50.79 62.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.036 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -70.35 -30.56 67.55 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.54 -33.92 76.75 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.65 0.659 . . . . 0.0 110.168 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 52.5 mt -80.1 -16.84 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.472 0.709 . . . . 0.0 110.782 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -90.22 -19.71 23.85 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -126.14 -28.53 3.13 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 91.2 mt -134.38 -8.35 2.56 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.54 1.518 . . . . 0.0 114.911 -170.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.6 p-10 -71.67 101.06 2.45 Favored 'General case' 0 C--O 1.202 -1.418 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.4 m-80 79.4 20.75 0.66 Allowed 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 124.281 3.219 . . . . 0.0 114.058 -161.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -75.71 162.99 27.75 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.065 -1.022 . . . . 0.0 110.641 167.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -80.0 140.16 36.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 175.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.1 ttt -160.41 138.4 9.84 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.831 0.852 . . . . 0.0 109.957 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 52.6 m-85 56.99 24.21 9.22 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.59 9.46 86.4 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.661 -0.575 . . . . 0.0 111.661 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -135.18 -168.91 2.27 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.905 1.282 . . . . 0.0 108.716 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -122.0 151.85 40.37 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.653 0.263 . . . . 0.0 111.221 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 10.5 ptm -127.25 75.74 1.61 Allowed 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 124.873 1.269 . . . . 0.0 109.203 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -53.35 128.1 27.19 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 115.482 -2.199 . . . . 0.0 112.266 -173.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.428 2.0 t -126.64 150.87 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.439 -3.304 . . . . 0.0 115.76 168.624 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -164.74 170.27 15.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.645 1.178 . . . . 0.0 109.71 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.0 t -74.53 145.54 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 45.4 t -86.15 170.04 12.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.55 0.74 . . . . 0.0 111.414 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -115.98 0.72 13.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.554 0.342 . . . . 0.0 110.479 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -76.24 150.15 82.61 Favored Pre-proline 0 CA--C 1.53 0.183 0 C-N-CA 123.685 0.794 . . . . 0.0 110.94 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.91 -38.48 1.22 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.953 2.435 . . . . 0.0 111.522 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.93 159.54 7.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.719 0.808 . . . . 0.0 110.213 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 50.8 mt -78.36 143.94 11.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.077 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 82.1 mtp -120.22 130.37 24.88 Favored Pre-proline 0 CA--C 1.528 0.112 0 CA-C-N 117.622 0.192 . . . . 0.0 111.498 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.34 170.09 20.07 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 124.033 3.155 . . . . 0.0 109.612 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.17 -123.91 1.78 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -72.42 157.89 36.79 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.035 0.534 . . . . 0.0 109.738 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 91.9 p -151.93 174.08 14.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.834 0.454 . . . . 0.0 110.273 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.97 3.25 4.05 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.82 -175.05 54.65 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -176.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 78.7 mt -143.94 166.46 24.9 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.332 1.053 . . . . 0.0 109.328 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.81 -30.42 68.98 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 122.304 -0.248 . . . . 0.0 110.821 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -120.46 13.7 11.84 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -147.41 163.12 28.73 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 -178.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.8 t -86.57 -32.34 20.71 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.66 0.384 . . . . 0.0 111.703 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.5 m -127.1 155.63 43.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.3 0.64 . . . . 0.0 111.296 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.9 p -79.17 3.31 18.09 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.7 0.4 . . . . 0.0 110.778 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -136.04 149.71 48.89 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -152.99 151.83 30.72 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.39 0.276 . . . . 0.0 110.597 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -121.58 137.83 54.57 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -130.89 4.34 4.5 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 94.7 p -66.76 -16.09 64.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.104 0.562 . . . . 0.0 111.997 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -114.08 1.29 14.57 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.117 0.567 . . . . 0.0 111.322 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.5 t -77.96 149.0 34.2 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.785 0.434 . . . . 0.0 111.483 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 478' ' ' ARG . 12.6 ttp180 -81.69 -8.02 59.66 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.737 0.415 . . . . 0.0 110.87 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -62.38 -21.58 65.46 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 122.386 0.274 . . . . 0.0 111.695 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -61.91 112.77 2.45 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -30.05 59.94 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.286 66.6 m-85 -97.98 11.94 35.84 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -74.53 -13.83 60.73 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -134.58 149.27 70.45 Favored Pre-proline 0 C--N 1.338 0.102 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.78 -24.73 21.08 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 123.211 2.607 . . . . 0.0 111.797 -177.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -76.84 -16.78 59.33 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.232 0.469 . . . . 0.0 110.584 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 63.1 mm-40 -92.53 -45.71 7.98 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 173.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.13 -18.69 61.6 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.798 0.439 . . . . 0.0 112.177 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.12 -22.79 44.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -124.09 -0.66 8.34 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -61.4 156.8 18.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.377 0.535 . . . . 0.0 111.143 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -150.85 139.75 20.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.4 mm -140.61 138.18 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.725 0.81 . . . . 0.0 109.293 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -150.21 173.37 14.01 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.625 0.77 . . . . 0.0 110.052 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -60.51 152.86 63.91 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 122.926 0.49 . . . . 0.0 109.908 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.61 159.34 51.38 Favored 'Trans proline' 0 N--CA 1.449 -1.124 0 C-N-CA 123.209 2.606 . . . . 0.0 110.352 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 93.9 p -156.59 177.52 11.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -83.75 -2.67 56.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.03 143.41 11.26 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 123.756 0.822 . . . . 0.0 112.376 175.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.32 149.61 47.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -120.41 151.39 39.36 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.517 0.727 . . . . 0.0 109.199 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -144.0 159.32 42.8 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.41 0.624 . . . . 0.0 112.018 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -149.17 167.76 25.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 102.99 -2.967 . . . . 0.0 102.99 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 56.68 57.49 4.74 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 122.226 -0.296 . . . . 0.0 111.182 -174.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -128.91 152.07 78.5 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.859 0.464 . . . . 0.0 110.597 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.78 154.51 31.48 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.515 2.81 . . . . 0.0 113.132 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.4 -16.48 63.93 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.494 0.718 . . . . 0.0 111.66 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -122.95 24.75 8.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.441 0.696 . . . . 0.0 110.835 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.03 -9.56 10.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -175.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.73 -177.32 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -165.306 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -28.64 -35.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.8 mt-10 -58.87 -46.3 88.14 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 116.915 -1.517 . . . . 0.0 114.553 170.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -87.66 -27.6 22.36 Favored 'General case' 0 C--N 1.354 0.792 0 CA-C-N 122.826 2.557 . . . . 0.0 106.861 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -66.65 -32.45 73.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.65 -46.26 39.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -76.44 -24.4 53.92 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.626 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.6 mt -74.91 -44.38 45.04 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 118.588 0.631 . . . . 0.0 110.203 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 86.4 m -66.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.53 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -69.54 -24.02 63.66 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -77.47 -30.89 53.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.266 0.227 . . . . 0.0 110.668 175.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 94.0 mt -86.17 -3.66 59.01 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.028 0.531 . . . . 0.0 111.141 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.04 -3.11 62.59 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 123.35 0.5 . . . . 0.0 112.377 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.8 t -77.36 148.47 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 CA-C-N 117.696 0.748 . . . . 0.0 111.825 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.94 133.97 51.99 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -75.37 152.67 85.82 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.727 0.411 . . . . 0.0 110.03 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -65.06 153.18 79.53 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.335 2.69 . . . . 0.0 111.579 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -83.88 -14.75 50.35 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 33.5 t -152.36 153.8 34.35 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 122.478 0.311 . . . . 0.0 110.321 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 60.9 t -145.81 145.94 19.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.44 0.696 . . . . 0.0 110.958 -175.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -146.45 145.23 30.15 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.645 0.778 . . . . 0.0 109.461 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 10.7 t -143.52 144.21 23.62 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.72 -173.08 4.44 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.9 p -139.05 -179.24 5.73 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.95 0.9 . . . . 0.0 110.157 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.37 -9.62 67.14 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 123.74 0.686 . . . . 0.0 112.232 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -88.51 -26.26 22.13 Favored 'General case' 0 C--N 1.338 0.109 0 CA-C-N 117.816 0.808 . . . . 0.0 110.281 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.4 t -165.62 152.66 10.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.908 0.883 . . . . 0.0 109.441 177.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -97.12 -6.02 35.96 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.526 0.33 . . . . 0.0 110.49 175.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.83 -26.64 16.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.177 0.591 . . . . 0.0 111.509 -176.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 25.9 t -159.66 161.8 35.03 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.143 0.429 . . . . 0.0 111.261 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 22.9 t -88.4 170.94 10.5 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.833 0.853 . . . . 0.0 111.932 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.4 t -152.49 160.01 43.28 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.636 1.175 . . . . 0.0 109.204 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.38 -173.49 46.22 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.351 -0.452 . . . . 0.0 112.643 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.51 160.22 26.06 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.584 0.754 . . . . 0.0 110.728 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.2 mt -139.12 162.65 34.43 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 125.265 1.426 . . . . 0.0 108.907 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -152.55 146.85 25.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 122.284 -0.26 . . . . 0.0 111.144 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.5 m-90 -122.72 171.81 8.89 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.788 1.235 . . . . 0.0 112.526 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -77.48 -7.77 56.72 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.915 0.486 . . . . 0.0 111.134 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 38.6 t -155.47 159.58 39.9 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.639 -0.663 . . . . 0.0 111.402 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.52 -34.19 73.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.818 0.447 . . . . 0.0 110.521 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 73.5 m -75.55 -23.83 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.093 0.157 . . . . 0.0 110.785 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -71.79 -35.93 70.15 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.69 -28.75 60.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.525 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.42 -38.77 55.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.697 0.399 . . . . 0.0 111.561 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -72.31 -36.2 68.84 Favored 'General case' 0 C--O 1.233 0.187 0 O-C-N 121.697 -0.627 . . . . 0.0 109.51 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.27 -20.48 63.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.9 -40.18 79.29 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 173.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.32 -39.35 95.86 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 119.792 -0.449 . . . . 0.0 111.984 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 558' ' ' PHE . . . . . 0.429 ' C ' HD22 ' A' ' 559' ' ' LEU 0.26 6.6 m-85 -88.52 -16.41 32.73 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.279 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 559' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 558' ' ' PHE . 4.2 mm? -115.01 -9.07 12.43 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -72.4 147.55 46.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.783 1.174 . . . . 0.0 109.588 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t60 57.24 17.53 3.67 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 37.0 t80 -70.1 138.75 52.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 178.082 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.98 133.74 41.63 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.076 -0.39 . . . . 0.0 111.875 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.6 mtm -83.68 152.43 24.75 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.626 0.371 . . . . 0.0 111.156 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -90.4 152.81 20.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -135.1 145.84 55.96 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.393 0.677 . . . . 0.0 109.917 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.62 -23.51 14.59 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 123.369 2.713 . . . . 0.0 112.599 -177.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -158.11 11.35 0.18 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.074 0.397 . . . . 0.0 111.574 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -71.27 148.05 43.5 Favored Glycine 0 CA--C 1.529 0.963 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.24 -24.76 16.46 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.523 2.815 . . . . 0.0 111.184 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.5 p90 -155.35 152.79 25.54 Favored Pre-proline 0 N--CA 1.454 -0.266 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 178.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -72.0 161.54 44.52 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.488 2.792 . . . . 0.0 111.297 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.89 142.38 50.67 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 102.545 -3.132 . . . . 0.0 102.545 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.256 0.7 OUTLIER -80.28 139.76 36.51 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.9 tt -84.47 152.17 24.14 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.414 1.085 . . . . 0.0 108.873 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.17 149.28 47.15 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 122.154 -0.341 . . . . 0.0 110.344 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.8 pp -153.95 162.63 41.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.106 0.479 . . . . 0.0 111.255 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 15.1 p -166.64 172.1 10.97 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.825 0.85 . . . . 0.0 110.75 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -56.14 127.23 29.63 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 33.2 t -81.97 148.89 28.45 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.259 1.0 OUTLIER -110.99 10.44 22.18 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 169.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.59 167.44 18.52 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.115 0.966 . . . . 0.0 111.491 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -93.99 -3.22 51.86 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -171.37 177.98 3.38 Favored 'General case' 0 C--N 1.338 0.101 0 C-N-CA 123.555 0.742 . . . . 0.0 110.16 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -134.92 21.33 3.51 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.812 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 178.137 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.446 " O3'" ' HE2' ' A' ' 415' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.504 1 O4'-C1'-N19 112.487 4.287 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C5'-C4'-C3' 110.21 -3.527 . 0.383 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.517 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.858 2 O4'-C1'-N19 113.02 4.82 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 1 C5'-C4'-C3' 108.485 -4.677 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 1 O4'-C1'-N19 113.728 5.528 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.532 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C5'-C4'-C3' 109.98 -3.68 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.858 0 C5'-C4'-C3' 110.686 -3.209 . 0.066 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.017 0 C3'-C2'-C1' 104.496 3.328 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.793 0 O4'-C1'-N19 111.3 3.1 . 0.219 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.823 1 C5'-C4'-C3' 108.082 -4.945 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.276 55.1 m-85 . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -74.09 170.73 53.05 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 111.53 -0.628 . . . . 0.0 111.53 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -69.85 165.31 31.49 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 124.135 3.223 . . . . 0.0 111.005 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -154.85 158.9 40.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.94 165.11 23.85 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.074 0.55 . . . . 0.0 111.346 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -75.48 -7.28 53.72 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.9 t -157.65 147.95 15.81 Favored Pre-proline 0 CA--C 1.531 0.219 0 O-C-N 122.149 -0.345 . . . . 0.0 111.196 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.39 -13.81 22.22 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 124.028 3.152 . . . . 0.0 111.909 172.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.4 t -100.38 151.47 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.558 0.743 . . . . 0.0 112.785 -177.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -130.7 153.75 48.66 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.396 1.478 . . . . 0.0 108.32 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -137.9 128.59 26.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.108 0.413 . . . . 0.0 111.018 -175.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.86 153.57 27.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.525 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.0 m-85 -142.56 173.5 11.48 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.33 9.72 78.93 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.22 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.2 mt -77.29 28.27 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.463 0.705 . . . . 0.0 111.849 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.65 -27.65 68.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -173.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.481 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -77.83 149.96 34.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 121.288 0.566 . . . . 0.0 111.16 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 48.2 t -68.46 -14.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.309 0.643 . . . . 0.0 112.635 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.3 -17.32 63.72 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 46.5 mmm -85.75 148.2 25.97 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 118.53 0.604 . . . . 0.0 110.866 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.79 158.71 28.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.378 0.671 . . . . 0.0 109.259 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 99.5 m -54.3 -40.6 68.06 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 122.322 0.249 . . . . 0.0 110.809 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.69 -38.69 77.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -75.95 -46.0 32.08 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.26 -40.64 80.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.403 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 2.4 t80 -76.15 -31.25 58.47 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -170.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.3 p30 -76.97 -28.44 55.14 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.714 1.143 . . . . 0.0 110.227 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.1 t -58.24 -57.79 9.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.566 1.7 p90 -76.56 -4.92 45.39 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 118.175 2.658 . . . . 0.0 118.175 173.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 42.7 t -73.85 -35.01 64.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.764 -0.585 . . . . 0.0 111.24 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.92 -12.41 11.1 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -87.92 -8.99 54.99 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 117.21 2.3 . . . . 0.0 117.21 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 176.87 -148.71 9.12 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.434 0.561 . . . . 0.0 112.733 -176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -107.12 130.43 54.69 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.102 0.561 . . . . 0.0 110.49 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.403 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.1 m -114.11 165.57 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -177.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -129.06 -53.71 1.2 Allowed 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -152.11 165.38 34.94 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.195 0.907 . . . . 0.0 113.045 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.87 147.04 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 124.6 1.16 . . . . 0.0 109.085 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -152.26 116.23 4.89 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.125 0.57 . . . . 0.0 111.376 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.86 158.08 29.6 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 115.821 1.786 . . . . 0.0 115.821 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -114.8 120.95 41.77 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.842 0.457 . . . . 0.0 112.123 -176.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -79.31 -13.06 59.89 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.9 0.48 . . . . 0.0 111.475 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 96.0 p -82.34 1.44 37.06 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.251 0.62 . . . . 0.0 111.895 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.442 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.4 mmtm -139.81 157.15 70.3 Favored Pre-proline 0 C--N 1.34 0.153 0 C-N-CA 124.311 1.044 . . . . 0.0 109.306 -177.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -68.08 -16.91 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.97 2.446 . . . . 0.0 111.343 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.79 100.65 0.14 Allowed Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.58 158.86 34.72 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.531 0.733 . . . . 0.0 109.633 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -159.64 148.29 17.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.109 0.481 . . . . 0.0 112.078 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.4 mtp -94.34 154.53 17.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.14 0.976 . . . . 0.0 108.99 170.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -145.38 151.43 15.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -134.33 135.64 42.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 8.0 ptp -166.04 174.61 9.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.611 0.764 . . . . 0.0 110.138 -173.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.84 120.47 11.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -72.39 -33.39 67.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -168.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.76 -86.61 0.02 OUTLIER Glycine 0 C--N 1.335 0.495 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -71.59 -30.89 66.34 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.37 -36.4 20.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 119.259 -0.976 . . . . 0.0 112.403 -174.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -84.45 -28.3 6.95 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 C-N-CA 118.808 -1.157 . . . . 0.0 110.049 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.86 -46.7 67.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.79 175.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -39.03 89.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.246 -0.284 . . . . 0.0 110.941 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.43 91.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.795 -0.566 . . . . 0.0 110.29 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 59.9 mt -78.47 -8.77 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.283 0.633 . . . . 0.0 111.209 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 54.4 m -102.22 -18.22 15.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -127.48 -29.56 2.67 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -169.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 89.4 mt -134.67 -11.08 2.38 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.467 1.485 . . . . 0.0 114.368 -172.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.71 101.0 2.45 Favored 'General case' 0 C--O 1.205 -1.272 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -168.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.626 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 14.8 m-80 76.88 21.72 1.15 Allowed 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 123.333 2.788 . . . . 0.0 113.741 -161.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -87.07 162.23 17.7 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.258 58.0 m-85 -76.96 138.68 39.81 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -158.74 137.46 11.09 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.448 0.699 . . . . 0.0 109.484 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.1 m-85 57.23 25.34 10.93 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 117.266 2.321 . . . . 0.0 117.266 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.3 9.59 86.88 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 -177.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -135.81 -164.16 1.5 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.057 1.343 . . . . 0.0 108.52 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -129.06 146.65 50.97 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.108 -0.37 . . . . 0.0 111.281 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptm -118.96 75.14 1.01 Allowed 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.947 0.899 . . . . 0.0 109.442 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.626 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.4 m120 -53.0 125.23 16.53 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 116.272 -1.823 . . . . 0.0 112.192 -173.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.424 2.0 t -128.74 150.6 34.55 Favored 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 113.455 -3.298 . . . . 0.0 116.434 169.446 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.1 t -159.61 172.25 18.14 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.212 1.405 . . . . 0.0 107.807 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.5 p -72.3 147.28 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 18.9 t -82.51 156.65 23.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.42 ' HE3' ' C6 ' ' B' ' 2' ' ' ' C' . 17.3 ptpt -96.6 -12.4 24.01 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.001 0.121 . . . . 0.0 110.954 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -83.75 153.45 64.33 Favored Pre-proline 0 N--CA 1.454 -0.252 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.03 -34.52 2.18 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.335 2.69 . . . . 0.0 112.306 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.52 159.04 11.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.177 0.444 . . . . 0.0 111.695 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 87.7 mt -83.72 150.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 173.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 62.0 mtm -125.5 130.24 24.16 Favored Pre-proline 0 CA--C 1.53 0.178 0 O-C-N 122.312 -0.243 . . . . 0.0 111.213 173.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.7 165.36 26.95 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.933 3.089 . . . . 0.0 110.87 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 147.62 -108.73 0.44 Allowed Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 177.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -72.51 162.43 29.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 120.837 0.351 . . . . 0.0 110.278 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.9 p -161.27 177.04 10.57 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.914 0.486 . . . . 0.0 110.321 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -144.46 163.44 33.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.96 162.62 54.39 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 121.11 0.283 . . . . 0.0 113.077 -174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.88 171.27 10.86 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.017 0.927 . . . . 0.0 109.94 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -69.33 -26.89 64.93 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.293 -0.254 . . . . 0.0 111.061 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -120.17 11.7 11.67 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.34 -171.6 28.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.801 -0.52 . . . . 0.0 111.801 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 70.2 m -124.91 -7.91 7.23 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -177.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.2 t -127.07 138.95 53.3 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 85.3 p -85.31 9.1 16.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.874 0.87 . . . . 0.0 111.627 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -138.24 151.61 47.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.09 146.51 25.58 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.691 0.396 . . . . 0.0 110.1 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -112.25 139.98 47.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -126.0 4.59 7.24 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 45.7 t -65.81 -20.64 66.32 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.915 0.486 . . . . 0.0 111.499 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -113.86 1.48 14.78 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.51 . . . . 0.0 111.423 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 42.3 t -77.67 147.28 35.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.894 0.378 . . . . 0.0 111.334 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.21 -8.32 48.86 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.816 0.447 . . . . 0.0 110.926 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -61.88 -20.03 63.29 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 122.76 0.424 . . . . 0.0 112.052 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -58.74 115.36 3.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.235 0.614 . . . . 0.0 109.627 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -74.78 -33.43 62.26 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -172.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -95.25 16.04 17.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.3 p -70.99 -10.9 60.55 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.4 149.94 67.08 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.94 -25.32 59.7 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.989 2.459 . . . . 0.0 111.614 176.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -75.49 -28.31 59.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.363 0.265 . . . . 0.0 110.698 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -81.97 -46.11 14.45 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.96 -16.97 61.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -78.19 -19.77 53.23 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.443 0.297 . . . . 0.0 111.785 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.04 -2.93 8.13 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -65.12 159.64 22.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.498 0.59 . . . . 0.0 110.317 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -151.79 145.94 25.35 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.3 mm -140.53 139.83 34.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.747 0.819 . . . . 0.0 109.356 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -150.11 166.38 29.96 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.179 0.991 . . . . 0.0 109.661 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.51 138.84 97.48 Favored Pre-proline 0 C--O 1.233 0.203 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.36 151.07 81.91 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.463 2.775 . . . . 0.0 111.339 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 83.1 p -148.42 -173.73 4.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.303 -175.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -83.74 4.72 27.61 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.813 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.15 137.97 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 73.3 mt -124.5 155.58 38.72 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.989 0.515 . . . . 0.0 109.782 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -121.75 144.44 48.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.352 1.061 . . . . 0.0 108.265 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -136.65 159.25 42.38 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.457 0.646 . . . . 0.0 110.688 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -152.27 168.45 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 103.722 -2.695 . . . . 0.0 103.722 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 57.61 57.49 4.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.678 0.391 . . . . 0.0 111.486 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -142.23 119.46 7.25 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 122.392 -0.193 . . . . 0.0 111.176 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.04 161.75 3.18 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 124.417 3.411 . . . . 0.0 113.219 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.52 -16.41 63.87 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.275 0.63 . . . . 0.0 111.914 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -94.07 -1.99 53.54 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.5 m -78.93 -11.5 13.15 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.9 m -55.25 179.07 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.226 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -168.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.655 ' H ' HG22 ' A' ' 510' ' ' THR . 89.0 tt0 12.09 -68.8 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.851 2.061 . . . . 0.0 114.189 175.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 510' ' ' THR . 95.8 mt-10 -54.36 -48.14 71.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -88.0 -23.57 23.77 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 121.941 2.155 . . . . 0.0 106.014 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -62.13 -40.8 97.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 118.259 -1.376 . . . . 0.0 113.468 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -72.61 -44.07 62.46 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -77.38 -18.9 56.93 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.491 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.5 mt -75.51 -39.16 40.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.116 0 CA-C-N 118.486 0.585 . . . . 0.0 109.509 173.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.8 -38.69 89.64 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.769 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -68.7 -29.36 67.78 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -75.08 -26.52 59.39 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.392 0.277 . . . . 0.0 110.775 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.72 -2.16 44.99 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 111.326 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.86 -0.7 61.22 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 123.295 0.474 . . . . 0.0 113.104 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.0 151.16 5.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.893 0.847 . . . . 0.0 112.206 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.42 149.84 49.72 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.937 0.398 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.94 152.92 91.02 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 123.112 0.565 . . . . 0.0 111.226 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.57 157.59 60.21 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.631 2.887 . . . . 0.0 110.529 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -89.22 -17.14 29.66 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.7 t -155.21 159.13 39.87 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.613 0.244 . . . . 0.0 111.421 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 62.6 t -143.13 144.93 23.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 C-N-CA 124.449 1.1 . . . . 0.0 110.09 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -148.18 140.97 24.66 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.18 143.74 29.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -154.89 -171.77 3.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.8 t -141.44 -172.15 3.46 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.765 0.826 . . . . 0.0 109.91 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 100.46 11.22 42.19 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 123.526 0.584 . . . . 0.0 112.373 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -126.95 -17.32 4.91 Favored 'General case' 0 C--N 1.339 0.148 0 CA-C-N 117.762 0.781 . . . . 0.0 112.593 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -163.56 152.96 14.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 117.876 0.307 . . . . 0.0 110.774 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.93 -8.09 31.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.921 0.489 . . . . 0.0 110.63 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -79.38 -41.85 26.86 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.254 0.622 . . . . 0.0 111.684 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.5 p -164.05 173.59 12.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 110.814 -173.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 45.5 p -83.44 177.74 8.33 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.547 0.689 . . . . 0.0 111.066 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.6 p -150.57 163.06 39.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.75 -169.67 42.65 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.827 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.33 160.28 23.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.448 0.699 . . . . 0.0 110.479 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.9 mt -139.27 157.96 44.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.858 1.263 . . . . 0.0 108.091 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -148.12 149.23 31.65 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.093 0.406 . . . . 0.0 111.995 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -127.12 175.06 8.41 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.351 1.461 . . . . 0.0 112.39 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -76.52 -12.3 60.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.609 0.364 . . . . 0.0 110.999 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.5 t -158.32 160.52 37.08 Favored 'General case' 0 C--O 1.232 0.163 0 O-C-N 121.808 -0.557 . . . . 0.0 110.851 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -75.15 -21.54 58.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.02 -0.425 . . . . 0.0 110.935 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.4 m -77.25 -25.67 51.73 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.019 0.372 . . . . 0.0 110.065 174.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -74.72 -34.05 62.51 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.245 0.618 . . . . 0.0 111.896 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.35 -28.96 57.03 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.386 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.5 tp -72.74 -39.25 67.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.734 0.243 . . . . 0.0 111.284 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -73.39 -39.03 65.41 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -26.27 62.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 176.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 556' ' ' LEU . . . . . 0.421 HD13 ' C ' ' A' ' 556' ' ' LEU . 1.6 tm? -68.11 -37.73 81.49 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 172.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.94 -30.05 75.51 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.559 -0.578 . . . . 0.0 112.325 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 7.5 m-85 -98.69 -8.25 26.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 118.924 2.935 . . . . 0.0 118.924 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.36 -8.69 10.51 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -72.05 145.36 48.31 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.354 0.979 . . . . 0.0 108.923 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.64 21.84 9.2 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.571 0.748 . . . . 0.0 112.326 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -61.54 134.24 56.62 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -81.11 121.21 25.82 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.047 -0.408 . . . . 0.0 110.732 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.8 152.61 18.33 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -67.27 162.36 22.9 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 169.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -151.09 121.34 3.68 Favored Pre-proline 0 CA--C 1.531 0.25 0 O-C-N 122.342 -0.224 . . . . 0.0 110.639 -178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -79.77 -16.05 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.284 2.656 . . . . 0.0 111.886 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -82.87 -12.45 57.39 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 173.11 173.76 39.72 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -71.6 -19.59 27.91 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.904 3.07 . . . . 0.0 111.5 -177.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -78.65 130.54 70.57 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.51 168.85 14.28 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.689 2.926 . . . . 0.0 111.486 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -129.82 142.37 50.69 Favored 'General case' 0 N--CA 1.457 -0.109 0 N-CA-C 103.049 -2.945 . . . . 0.0 103.049 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.251 1.0 OUTLIER -81.67 131.3 35.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -178.053 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -78.5 149.29 33.17 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.03 147.25 46.09 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.566 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.92 159.84 38.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.647 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 20.4 p -160.81 174.74 13.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.024 0.929 . . . . 0.0 110.144 -177.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -58.09 124.45 19.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.438 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 29.3 t -79.76 149.52 31.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -171.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.266 0.8 OUTLIER -111.38 9.97 21.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 169.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.82 164.42 19.66 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.231 1.012 . . . . 0.0 111.863 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -92.83 -3.07 55.3 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.709 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -170.6 177.0 4.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.746 0.818 . . . . 0.0 110.074 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.41 28.33 1.2 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.072 0.549 . . . . 0.0 111.64 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 117.426 -1.273 . . . . 0.0 111.154 -177.797 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.525 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.683 1 O4'-C1'-N19 112.487 4.287 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.42 ' C6 ' ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C5'-C4'-C3' 110.767 -3.155 . 0.447 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 1 C3'-C2'-C1' 105.378 4.309 . 0.126 0b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 1 C5'-C4'-C3' 108.957 -4.362 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.814 1 O4'-C1'-N19 113.185 4.985 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.456 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C3'-C2'-C1' 104.625 3.473 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.778 0 O4'-C1'-N19 111.235 3.035 . 0.077 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.939 0 C3'-C2'-C1' 104.871 3.745 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.438 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.92 0 O4'-C1'-N19 111.066 2.866 . 0.177 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 1 C5'-C4'-C3' 108.315 -4.79 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.26 7.8 p90 . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -75.63 -176.6 40.02 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 111.959 -0.456 . . . . 0.0 111.959 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.4 170.09 1.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.774 3.65 . . . . 0.0 112.821 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -148.59 152.3 36.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.915 0.486 . . . . 0.0 110.728 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.72 26.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.066 0.547 . . . . 0.0 110.882 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -82.81 -0.93 50.23 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.1 t -156.96 144.77 14.08 Favored Pre-proline 0 C--O 1.232 0.151 0 C-N-CA 122.804 0.442 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.7 -15.29 33.56 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.209 2.606 . . . . 0.0 110.836 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.01 150.91 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.1 153.03 42.49 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.933 0.893 . . . . 0.0 109.707 -175.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' MET . . . . . 0.432 ' O ' HG13 ' A' ' 448' ' ' VAL . 97.0 mmm -120.32 147.59 44.82 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 123.55 0.74 . . . . 0.0 111.39 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 5.9 p -139.65 146.2 25.67 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.437 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 10.5 m-85 -143.21 173.71 11.35 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -177.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.56 61.75 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.673 -0.571 . . . . 0.0 111.673 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 20.7 mt -75.73 32.32 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.881 0.872 . . . . 0.0 111.481 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -71.08 14.29 0.16 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -174.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -137.12 149.57 47.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.126 0.571 . . . . 0.0 110.811 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 39.3 t -69.53 -13.63 62.43 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.495 0.718 . . . . 0.0 112.057 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -67.77 -20.61 65.24 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 122.676 0.39 . . . . 0.0 111.875 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 67.4 mtp -94.28 148.57 22.08 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.069 -0.394 . . . . 0.0 110.615 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.78 154.39 28.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.3 p -59.17 -30.69 68.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -176.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -70.09 -43.23 71.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -76.03 -42.1 48.84 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 41.4 t -69.32 -42.31 81.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -76.29 -29.99 57.59 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.805 -0.616 . . . . 0.0 111.19 -171.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -75.95 -31.04 58.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.344 0.975 . . . . 0.0 109.857 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.97 -55.63 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.55 1.8 p90 -76.59 -4.86 45.12 Favored 'General case' 0 C--N 1.339 0.147 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.8 t -72.39 -34.31 67.82 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 122.008 -0.432 . . . . 0.0 110.867 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.52 -14.46 19.88 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.096 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.33 -3.48 58.46 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.6 -174.83 43.29 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 119.193 0.906 . . . . 0.0 113.262 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -76.34 130.12 37.62 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -129.93 -61.3 1.0 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 176.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -148.39 165.13 32.02 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -170.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.37 145.01 21.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 124.774 1.23 . . . . 0.0 108.485 171.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -153.7 121.49 5.98 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -76.98 166.93 22.66 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.8 ptp -142.82 138.0 30.04 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 118.879 0.763 . . . . 0.0 112.714 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -5.56 53.98 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.706 1.202 . . . . 0.0 112.156 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.0 t -78.06 -4.97 49.9 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.214 0.605 . . . . 0.0 111.646 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.49 155.57 67.15 Favored Pre-proline 0 CA--C 1.53 0.184 0 C-N-CA 123.993 0.917 . . . . 0.0 109.918 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 -13.75 38.14 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.392 2.728 . . . . 0.0 111.894 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.43 87.27 0.07 OUTLIER Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -152.48 160.44 43.25 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.963 0.505 . . . . 0.0 110.838 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.61 170.43 22.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.663 0.385 . . . . 0.0 110.434 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 22.1 mtm -123.97 157.34 34.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.034 0.934 . . . . 0.0 108.828 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -142.0 152.03 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.756 0.822 . . . . 0.0 110.38 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.73 132.87 42.78 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtp -155.13 172.39 18.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -171.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.08 127.05 30.6 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 170.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -73.07 -34.76 66.43 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -168.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.11 -89.1 0.01 OUTLIER Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -72.78 -26.54 61.57 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.7 -36.43 17.4 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 118.838 -1.145 . . . . 0.0 111.668 -174.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.79 -27.31 6.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.205 0 C-N-CA 118.553 -1.259 . . . . 0.0 109.374 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -68.77 -53.39 22.05 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.108 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 25.6 mtm180 -68.9 -29.99 68.39 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.05 78.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.094 -0.643 . . . . 0.0 110.011 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.72 -9.97 12.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.303 0.641 . . . . 0.0 111.084 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 29.9 m -96.77 -21.33 17.61 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -125.79 -26.9 3.41 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -169.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 88.1 mt -134.59 -8.75 2.48 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.906 1.684 . . . . 0.0 114.624 -172.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.637 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.2 p-10 -71.63 101.09 2.43 Favored 'General case' 0 C--O 1.207 -1.157 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -168.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.573 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 16.3 m-80 77.47 22.02 0.97 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 123.98 3.082 . . . . 0.0 114.054 -160.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -76.87 163.06 27.12 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.906 -1.121 . . . . 0.0 110.207 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -68.71 136.61 53.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 173.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.9 ttt -158.43 142.26 15.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 442' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 554' ' ' GLU 0.273 53.2 m-85 59.92 15.63 5.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.514 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.16 9.17 70.74 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -136.03 -171.14 2.8 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.497 1.119 . . . . 0.0 108.439 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -128.43 136.2 50.54 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.088 -0.383 . . . . 0.0 110.795 178.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -94.82 -152.51 0.36 Allowed 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 31.4 t-20 -159.22 129.28 5.69 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 115.903 -1.999 . . . . 0.0 110.521 175.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.637 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.459 2.1 t -124.03 145.25 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 112.864 -3.534 . . . . 0.0 115.147 167.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -161.29 164.76 29.99 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.869 0.868 . . . . 0.0 109.442 -176.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.4 p -75.29 150.69 6.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 37.0 t -93.29 158.09 15.92 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.726 0.81 . . . . 0.0 111.997 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -96.85 -7.88 32.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.667 0.387 . . . . 0.0 110.552 175.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -71.01 147.52 93.9 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.494 0.717 . . . . 0.0 110.526 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.9 -32.91 2.39 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.195 2.597 . . . . 0.0 111.435 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.77 158.87 9.34 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.544 0.738 . . . . 0.0 110.395 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 67.5 mt -82.89 133.42 29.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 34.2 mmm -98.0 129.32 31.3 Favored Pre-proline 0 N--CA 1.454 -0.274 0 C-N-CA 122.374 0.27 . . . . 0.0 111.241 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.32 161.95 37.04 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.437 2.758 . . . . 0.0 109.024 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 151.76 -129.52 2.85 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 121.128 -0.558 . . . . 0.0 111.899 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -72.32 171.3 12.43 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.267 0.627 . . . . 0.0 111.149 -177.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.6 p -156.01 170.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.538 0.735 . . . . 0.0 109.403 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -128.75 5.88 5.55 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.39 -170.95 55.16 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.215 -0.303 . . . . 0.0 112.499 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.3 mt -143.01 168.35 19.91 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.081 0.952 . . . . 0.0 109.592 -178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -75.22 -24.34 57.71 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 122.364 -0.21 . . . . 0.0 110.45 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -120.61 20.27 11.8 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.618 0.767 . . . . 0.0 110.825 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.33 167.32 36.86 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.604 -0.685 . . . . 0.0 112.289 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 t -93.66 -26.67 16.95 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.73 0.412 . . . . 0.0 112.111 -176.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.7 t -127.02 148.03 50.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.986 0.515 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.4 p -90.17 7.94 35.48 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.394 0.678 . . . . 0.0 111.418 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -134.34 145.82 49.37 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -156.57 151.73 26.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.888 0.375 . . . . 0.0 110.663 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.1 130.32 41.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.587 0.755 . . . . 0.0 112.25 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.54 -12.03 41.12 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 117.542 2.423 . . . . 0.0 117.542 -173.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 43.9 t -68.93 -29.93 68.27 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.641 0.257 . . . . 0.0 110.357 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -80.0 -18.38 50.4 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.699 0.399 . . . . 0.0 111.117 177.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.2 m -93.87 -4.0 50.78 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.873 0.469 . . . . 0.0 112.056 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 478' ' ' ARG . 0.1 OUTLIER 61.66 3.96 0.96 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.311 1.044 . . . . 0.0 112.83 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -59.61 -17.64 34.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -57.05 122.27 11.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.247 0.619 . . . . 0.0 110.625 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -81.05 -33.66 33.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.304 64.7 m-85 -98.0 10.46 40.29 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 117.376 2.362 . . . . 0.0 117.376 -178.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 86.5 p -71.79 -10.72 60.19 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -135.96 148.98 67.19 Favored Pre-proline 0 C--O 1.232 0.136 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 179.623 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.47 -24.63 63.64 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 123.237 2.625 . . . . 0.0 111.554 176.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -73.97 -27.5 61.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.344 0.257 . . . . 0.0 110.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -88.44 -43.17 11.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 175.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.39 63.79 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.48 -18.61 44.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -124.06 -4.9 7.94 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -62.93 158.97 17.85 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.105 0.411 . . . . 0.0 110.752 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.405 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 13.0 ptp180 -150.03 144.91 26.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.5 mm -136.29 153.03 30.69 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 C-N-CA 123.891 0.876 . . . . 0.0 108.724 -175.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -155.01 162.26 41.13 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -57.28 153.01 28.54 Favored Pre-proline 0 CA--C 1.531 0.225 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -63.81 143.41 86.06 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.923 2.416 . . . . 0.0 109.644 -177.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.4 t -153.63 171.93 18.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.774 0.43 . . . . 0.0 110.205 -173.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -83.73 2.31 38.48 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.265 -0.272 . . . . 0.0 110.877 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.39 137.81 24.82 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 71.0 mt -125.39 156.09 39.34 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.081 0.553 . . . . 0.0 109.691 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -125.09 132.79 53.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -120.96 160.59 23.21 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 111.505 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -147.79 153.6 39.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 28.0 m120 55.52 57.47 5.32 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.072 -175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -113.6 153.06 45.9 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 122.897 0.479 . . . . 0.0 110.205 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -57.7 153.63 41.84 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.493 2.795 . . . . 0.0 112.696 -177.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.65 -16.3 63.79 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.381 0.672 . . . . 0.0 112.059 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -122.95 25.0 8.77 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.484 0.714 . . . . 0.0 110.95 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.61 -9.35 10.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 512' ' ' GLU . 0.2 OUTLIER -54.88 -177.29 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 117.214 -1.374 . . . . 0.0 114.222 -165.016 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.506 ' H ' HG22 ' A' ' 510' ' ' THR . 8.8 pm0 -30.86 -33.55 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.397 1.453 . . . . 0.0 114.77 -167.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.0 mt-10 -60.3 -45.64 92.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 117.047 -1.454 . . . . 0.0 114.723 170.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -87.53 -30.03 20.89 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 122.745 2.52 . . . . 0.0 106.528 -173.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -62.44 -33.81 75.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -76.15 -42.71 45.8 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -79.84 -19.27 48.77 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.659 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.2 -44.87 42.75 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 118.698 0.681 . . . . 0.0 110.081 175.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.6 m -64.19 -33.93 76.91 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.902 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -67.28 -37.39 83.35 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.013 0.435 . . . . 0.0 112.01 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -74.46 -30.71 61.98 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.707 0.403 . . . . 0.0 111.124 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.35 -4.61 58.99 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.649 0.379 . . . . 0.0 111.926 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 71.95 33.6 62.58 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.62 159.63 42.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.57 0.748 . . . . 0.0 112.889 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.08 149.09 50.83 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.138 0.575 . . . . 0.0 111.736 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -91.13 157.13 43.33 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.572 0.749 . . . . 0.0 111.023 -178.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -68.23 160.83 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.575 2.85 . . . . 0.0 111.196 174.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -97.87 -18.6 18.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 38.1 m -148.49 156.34 42.33 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.671 . . . . 0.0 110.959 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 59.7 t -143.98 148.22 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.543 0.737 . . . . 0.0 110.863 -175.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -147.35 142.36 27.02 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 123.804 0.842 . . . . 0.0 108.884 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -140.51 142.82 30.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 122.99 0.516 . . . . 0.0 112.282 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -156.09 -175.61 5.52 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -178.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.2 p -142.71 -169.09 2.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.465 1.106 . . . . 0.0 109.336 178.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.43 8.85 62.25 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.698 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.02 9.62 2.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 117.699 0.749 . . . . 0.0 111.371 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 42.5 t -158.63 157.62 32.24 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.765 0.826 . . . . 0.0 109.543 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -116.96 -5.34 11.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.996 0.518 . . . . 0.0 111.037 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -89.91 -50.17 6.19 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 122.843 0.457 . . . . 0.0 112.205 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 80.6 p -165.53 179.0 6.35 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 122.77 0.428 . . . . 0.0 110.94 -177.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 74.3 m -70.22 168.95 14.69 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.8 t -147.07 163.96 34.58 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.58 1.552 . . . . 0.0 108.398 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.12 -171.92 44.92 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.126 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.82 160.31 22.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.8 0.84 . . . . 0.0 110.484 -177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.3 mt -140.66 158.16 44.38 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.647 1.179 . . . . 0.0 108.936 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -148.72 152.21 36.23 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 117.607 0.185 . . . . 0.0 111.228 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.4 m-90 -128.42 167.84 16.45 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.869 1.268 . . . . 0.0 112.785 -177.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -70.53 -8.32 50.42 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -158.44 161.22 37.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.51 0.324 . . . . 0.0 110.932 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -66.13 -34.83 78.94 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.906 0.482 . . . . 0.0 110.219 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.9 p -78.35 -25.82 46.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.425 0.29 . . . . 0.0 110.893 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -68.79 -35.34 76.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.39 65.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 48.0 tp -65.51 -40.06 92.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.613 0.244 . . . . 0.0 110.585 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 554' ' ' GLU . . . . . 0.484 ' HG3' ' CE1' ' A' ' 442' ' ' PHE . 39.8 tt0 -64.27 -47.93 77.67 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.479 0.657 . . . . 0.0 110.712 177.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.86 -19.2 61.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.62 -44.29 82.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 173.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.9 -45.69 96.03 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.284 19.0 m-85 -76.86 -32.02 57.22 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 119.103 3.001 . . . . 0.0 119.103 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 57.8 mt -90.73 -19.29 23.71 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 119.504 1.047 . . . . 0.0 112.933 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -73.99 145.34 44.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.131 0.878 . . . . 0.0 110.118 -178.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 57.54 12.62 1.58 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.431 1.093 . . . . 0.0 113.091 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 40.1 t80 -72.9 138.83 46.45 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -71.73 132.83 45.08 Favored 'General case' 0 N--CA 1.457 -0.114 0 O-C-N 122.212 -0.305 . . . . 0.0 111.706 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.1 mtm -83.73 152.56 24.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.59 0.356 . . . . 0.0 110.96 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.22 146.84 45.19 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -155.85 78.02 4.49 Favored Pre-proline 0 N--CA 1.454 -0.244 0 O-C-N 122.165 -0.335 . . . . 0.0 110.669 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -71.0 -8.6 23.97 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.214 2.609 . . . . 0.0 111.029 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -93.83 5.82 50.41 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.407 0.683 . . . . 0.0 112.366 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -154.31 168.05 32.51 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-N 118.316 0.507 . . . . 0.0 112.033 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.03 -18.03 21.7 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 124.26 3.307 . . . . 0.0 112.48 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -150.57 151.03 30.0 Favored Pre-proline 0 N--CA 1.455 -0.202 0 N-CA-C 116.232 1.938 . . . . 0.0 116.232 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.77 164.46 33.56 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.806 3.004 . . . . 0.0 111.746 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -129.98 142.35 50.64 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 103.047 -2.945 . . . . 0.0 103.047 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -76.65 142.21 40.7 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.864 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.1 tt -83.88 150.32 25.79 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.196 0.998 . . . . 0.0 108.457 173.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -134.0 151.38 51.42 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 118.475 0.58 . . . . 0.0 111.147 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.4 pp -159.46 167.69 28.07 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.104 0.478 . . . . 0.0 111.43 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 12.5 p -162.6 174.05 13.13 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.293 1.037 . . . . 0.0 110.409 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -57.36 121.38 10.05 Favored 'General case' 0 C--N 1.34 0.156 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.432 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 38.9 t -77.83 149.15 34.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 0.6 OUTLIER -110.98 9.93 22.19 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 114.7 1.371 . . . . 0.0 114.7 169.545 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.22 166.57 16.06 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.161 0.984 . . . . 0.0 111.84 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -93.32 -3.03 54.21 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.84 177.97 3.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.575 0.75 . . . . 0.0 110.04 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -144.62 31.8 1.18 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.762 0.425 . . . . 0.0 111.607 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.89 -178.864 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.437 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.7 1 O4'-C1'-N19 112.453 4.253 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 O4'-C1'-N19 111.506 3.306 . 0.414 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.982 0 C3'-C2'-C1' 105.087 3.985 . 0.132 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.706 1 C5'-C4'-C3' 109.182 -4.212 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 1 O4'-C1'-N19 113.784 5.584 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.493 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C5'-C4'-C3' 110.024 -3.651 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.857 0 C5'-C4'-C3' 111.22 -2.853 . 0.075 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 C3'-C2'-C1' 104.647 3.496 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.432 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.888 0 O4'-C1'-N19 111.271 3.071 . 0.223 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.929 1 C5'-C4'-C3' 107.651 -5.233 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.256 54.1 m-85 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 115.108 1.522 . . . . 0.0 115.108 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -72.82 176.57 42.91 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.38 174.85 9.44 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.274 3.316 . . . . 0.0 110.719 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -147.89 154.59 40.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 120.868 0.366 . . . . 0.0 110.815 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.43 161.14 30.1 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.151 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -75.44 -5.71 46.42 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.2 t -158.71 146.7 13.68 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 122.895 0.478 . . . . 0.0 110.553 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.21 -16.79 40.12 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.288 2.659 . . . . 0.0 110.519 174.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.57 148.77 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.7 tt -137.6 152.0 48.93 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.771 1.229 . . . . 0.0 107.966 -178.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.1 tpt -134.59 130.11 35.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.397 0.142 . . . . 0.0 110.779 -172.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.68 152.85 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.538 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.8 m-85 -139.91 172.16 13.17 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 104.624 -2.361 . . . . 0.0 104.624 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.84 9.42 77.8 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 120.141 -0.255 . . . . 0.0 112.653 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.8 mt -79.02 27.89 0.23 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.553 0.676 . . . . 0.0 112.244 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.81 -41.46 95.77 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -67.04 146.22 54.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.051 0.453 . . . . 0.0 111.016 -178.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 56.6 m -68.68 -10.12 54.34 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -173.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -73.17 -19.62 61.08 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 117.939 0.336 . . . . 0.0 111.612 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 86.8 mmm -82.32 146.65 29.29 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.157 0.435 . . . . 0.0 110.587 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -160.92 155.74 23.89 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -59.13 -36.79 75.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -176.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -68.23 -39.33 82.37 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -75.93 -47.51 24.9 Favored 'General case' 0 C--N 1.34 0.153 0 O-C-N 122.192 -0.318 . . . . 0.0 111.651 -173.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.38 -37.74 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.8 -31.84 57.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -75.94 -29.9 58.51 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.703 1.138 . . . . 0.0 110.296 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -60.13 -55.8 21.74 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 2.5 p90 -76.57 -3.93 40.18 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 117.505 2.409 . . . . 0.0 117.505 174.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 40.6 t -74.95 -35.0 62.14 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.059 -0.401 . . . . 0.0 110.803 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.09 -15.83 26.66 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.13 -7.39 59.64 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 117.295 2.331 . . . . 0.0 117.295 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.64 -143.21 6.99 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 -176.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -113.77 132.94 55.66 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.801 0.44 . . . . 0.0 110.773 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.5 8.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -117.63 -67.42 0.99 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -154.45 170.51 21.21 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.73 148.48 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.066 0 C-N-CA 123.845 0.858 . . . . 0.0 109.42 -177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -152.31 108.52 3.4 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 122.576 0.351 . . . . 0.0 111.415 -174.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -73.24 163.88 27.48 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 24.0 ptp -142.18 142.03 32.66 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -5.57 54.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.742 1.617 . . . . 0.0 112.987 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.6 t -77.87 -8.18 57.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.109 0.563 . . . . 0.0 112.238 -172.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.42 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 45.2 mmtm -141.03 157.52 66.89 Favored Pre-proline 0 CA--C 1.528 0.12 0 C-N-CA 123.644 0.777 . . . . 0.0 109.598 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -67.54 -12.23 34.92 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.181 2.588 . . . . 0.0 111.496 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.05 95.4 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.56 160.41 38.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.208 0.603 . . . . 0.0 110.05 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.03 153.95 23.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.22 0.533 . . . . 0.0 111.732 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 83.3 mtp -96.97 153.29 17.99 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.948 0.899 . . . . 0.0 108.985 172.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.8 t -145.51 153.83 13.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -139.07 134.29 32.75 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 30.3 mtp -151.86 173.31 14.94 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 123.757 0.823 . . . . 0.0 109.388 -170.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.31 125.07 23.92 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 169.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.93 -33.1 65.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -167.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.17 -89.33 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -73.74 -23.69 59.79 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.97 -32.56 15.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 118.737 -1.185 . . . . 0.0 112.107 -175.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.2 -25.06 6.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 120.179 1.354 . . . . 0.0 109.082 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -68.53 -50.15 54.2 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 118.056 0.389 . . . . 0.0 111.302 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.64 -37.0 85.32 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.35 80.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.732 0.697 . . . . 0.0 110.674 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.2 mt -77.72 -12.76 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 123.028 0.531 . . . . 0.0 110.81 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.8 m -96.8 -18.96 19.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.449 ' C ' HD22 ' A' ' 436' ' ' LEU . 92.9 m-70 -129.5 -25.76 2.6 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 116.161 1.912 . . . . 0.0 116.161 -169.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.9 mm? -129.52 -14.32 4.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.144 1.338 . . . . 0.0 113.473 -172.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.662 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 32.8 p-10 -71.94 100.91 2.55 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -168.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.1 m-80 76.69 21.27 1.28 Allowed 'General case' 0 N--CA 1.481 1.088 0 O-C-N 117.916 -2.99 . . . . 0.0 112.264 -162.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -84.03 157.45 21.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -77.51 139.37 39.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.6 ttt -159.12 138.61 11.55 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.022 0.529 . . . . 0.0 109.597 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.399 49.8 m-85 56.92 25.79 10.95 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 -178.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 77.95 10.33 86.3 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 111.501 -0.639 . . . . 0.0 111.501 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -134.83 -167.3 1.96 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.861 1.264 . . . . 0.0 108.913 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -132.29 147.81 52.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.285 0.234 . . . . 0.0 111.031 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 18.7 ptt? -125.36 87.23 2.67 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 176.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.0 m120 -55.45 128.35 33.92 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 115.634 -2.127 . . . . 0.0 111.907 -174.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.662 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.423 2.4 t -126.82 154.15 36.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.28 -3.368 . . . . 0.0 116.059 169.052 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 37.9 t -162.09 167.42 24.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.568 1.547 . . . . 0.0 107.757 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.93 147.91 10.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 26.2 t -79.44 165.18 23.33 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 122.52 0.328 . . . . 0.0 110.5 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.4 31.56 6.27 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.412 ' HB2' ' HD2' ' A' ' 454' ' ' PRO . 12.0 pt20 -137.12 160.91 64.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 454' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' A' ' 453' ' ' GLN . 83.3 Cg_endo -75.0 -37.1 2.18 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.986 2.457 . . . . 0.0 116.198 -167.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -166.01 154.5 11.06 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.946 1.248 . . . . 0.0 112.889 -176.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 66.0 mt -77.05 150.83 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 173.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 54.9 mtm -129.27 136.79 29.7 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 117.584 0.175 . . . . 0.0 111.319 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.78 168.75 23.65 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.085 3.19 . . . . 0.0 110.564 177.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 143.37 -115.04 0.88 Allowed Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -72.43 153.55 41.35 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.1 0.56 . . . . 0.0 110.454 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 46.9 m -152.96 172.56 16.62 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.135 0.974 . . . . 0.0 110.03 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -144.58 164.07 32.01 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -83.38 132.08 10.83 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.22 163.37 26.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 174.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.69 -18.52 64.95 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -120.55 23.11 10.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.102 0.561 . . . . 0.0 109.931 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.97 -162.31 15.75 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.691 -0.631 . . . . 0.0 112.351 -176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 98.2 p -133.1 -10.74 2.95 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 122.727 0.411 . . . . 0.0 112.001 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.1 t -127.09 155.9 42.55 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.912 0.485 . . . . 0.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 80.2 p -115.72 8.96 15.07 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.446 0.698 . . . . 0.0 111.794 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -135.5 146.29 47.96 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -155.37 157.65 37.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.468 0.175 . . . . 0.0 110.64 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -128.77 139.35 52.24 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -173.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -133.78 5.07 3.63 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 31.9 t -65.39 -22.69 66.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.266 0.627 . . . . 0.0 111.825 -174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -113.89 1.48 14.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.156 0.582 . . . . 0.0 111.479 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -79.66 153.33 29.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.526 0.33 . . . . 0.0 111.365 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -85.42 -7.51 58.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.509 0.324 . . . . 0.0 111.283 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.13 -20.74 59.81 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -60.5 127.61 32.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -70.11 -33.76 72.25 Favored 'General case' 0 N--CA 1.458 -0.066 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -170.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.363 55.8 m-85 -98.14 17.53 18.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.5 t -60.0 -28.57 67.83 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -172.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.56 155.32 75.37 Favored Pre-proline 0 C--N 1.339 0.129 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -178.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.27 -25.37 76.64 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.306 2.671 . . . . 0.0 112.066 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -74.65 -29.75 61.37 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -80.43 -45.42 17.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.78 66.12 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.6 -25.0 56.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.936 0.335 . . . . 0.0 111.609 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -124.02 3.84 8.67 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -61.19 154.7 22.64 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.425 0.557 . . . . 0.0 111.679 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -154.63 141.87 19.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.0 mm -137.22 148.66 26.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.648 0.779 . . . . 0.0 109.337 -174.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -148.52 170.03 18.96 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.512 0.725 . . . . 0.0 110.59 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -64.43 157.09 74.13 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.71 148.32 90.16 Favored 'Trans proline' 0 N--CA 1.448 -1.197 0 C-N-CA 122.524 2.15 . . . . 0.0 109.808 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.9 t -153.95 173.66 15.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.815 0.446 . . . . 0.0 109.839 -173.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -83.74 -3.18 57.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.279 -0.263 . . . . 0.0 110.732 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -96.95 138.22 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 176.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 65.6 mt -125.5 156.52 38.85 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.19 0.596 . . . . 0.0 109.862 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -124.53 143.42 50.68 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -132.96 160.13 37.98 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.977 0.418 . . . . 0.0 111.452 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -144.16 150.96 38.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 51.83 57.42 6.54 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.304 1.042 . . . . 0.0 112.587 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -104.14 156.33 35.89 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.512 0.725 . . . . 0.0 110.302 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.83 153.04 32.65 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.317 2.678 . . . . 0.0 112.742 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.67 -16.34 63.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.442 0.697 . . . . 0.0 112.047 -176.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -122.92 20.99 9.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.523 0.729 . . . . 0.0 110.949 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.74 -16.12 19.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.47 -177.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -165.849 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.677 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -22.72 -41.04 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -170.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.2 mt-10 -58.49 -47.53 83.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 117.268 -1.349 . . . . 0.0 114.358 172.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -87.0 -28.32 22.71 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 122.416 2.371 . . . . 0.0 106.776 -172.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -65.35 -37.57 87.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 119.22 -0.992 . . . . 0.0 113.599 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -75.98 -37.66 58.28 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -81.71 -22.16 37.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.491 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.1 mt -75.94 -41.46 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 CA-C-N 118.624 0.647 . . . . 0.0 110.065 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.0 m -67.88 -34.77 77.31 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.089 0.404 . . . . 0.0 111.092 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.51 -34.74 72.65 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -69.19 -25.13 64.18 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.494 0.317 . . . . 0.0 110.922 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.81 -5.18 35.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.332 0.653 . . . . 0.0 111.552 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.2 -3.86 43.96 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.473 0.559 . . . . 0.0 113.02 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.8 m -78.79 164.56 3.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 CA-C-N 117.777 0.789 . . . . 0.0 112.522 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -67.37 149.1 50.75 Favored 'General case' 0 C--N 1.338 0.088 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -84.17 149.06 54.78 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.889 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.33 150.0 70.28 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.127 2.551 . . . . 0.0 110.589 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -85.24 -18.18 34.77 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 35.7 m -150.51 155.44 39.49 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.41 0.684 . . . . 0.0 110.982 176.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 91.7 t -144.01 147.92 19.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 123.644 0.777 . . . . 0.0 110.072 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -149.71 141.75 23.91 Favored 'General case' 0 N--CA 1.457 -0.081 0 C-N-CA 123.311 0.644 . . . . 0.0 109.369 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.71 142.74 31.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 123.227 0.611 . . . . 0.0 112.089 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -155.94 -173.8 4.68 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 99.0 p -138.53 -171.08 2.97 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.276 1.031 . . . . 0.0 110.115 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.52 7.77 57.79 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 119.779 -0.456 . . . . 0.0 112.326 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -125.56 -14.03 6.41 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 117.594 0.697 . . . . 0.0 112.154 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 34.8 t -162.23 148.31 13.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.861 0.464 . . . . 0.0 110.502 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -97.76 -8.07 29.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.916 0.486 . . . . 0.0 110.614 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -85.03 -38.64 18.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.245 0.618 . . . . 0.0 112.116 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 3.6 m -161.82 165.41 27.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.938 0.495 . . . . 0.0 111.816 -172.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 66.2 m -80.04 170.21 16.78 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.612 0.765 . . . . 0.0 111.697 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.2 m -142.97 165.06 28.38 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 124.392 1.077 . . . . 0.0 108.688 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.0 -170.08 43.23 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.046 -178.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.84 158.81 29.47 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.908 0.883 . . . . 0.0 110.349 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.3 mt -139.96 158.71 43.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 108.665 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.6 148.63 28.87 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.171 -0.331 . . . . 0.0 111.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -123.77 170.91 10.06 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 124.818 1.247 . . . . 0.0 112.644 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.81 -10.64 59.7 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.739 0.415 . . . . 0.0 111.037 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -156.48 160.39 39.51 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.678 -0.639 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -69.81 -30.67 68.25 Favored 'General case' 0 C--N 1.337 0.055 0 C-N-CA 122.412 0.285 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.4 p -75.36 -27.38 59.12 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -74.16 -32.49 63.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.597 0.359 . . . . 0.0 111.22 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.21 -36.95 58.35 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 175.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 37.3 tp -70.57 -37.4 73.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.321 -0.237 . . . . 0.0 111.446 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -70.69 -39.82 73.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.251 0.8 OUTLIER -68.99 -20.25 64.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 175.261 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.05 -42.55 89.37 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.18 -30.13 75.27 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.684 -0.509 . . . . 0.0 111.949 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.337 9.6 m-85 -96.74 -2.97 43.27 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 66.0 mt -127.25 -9.13 5.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -73.87 147.01 43.65 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.689 1.132 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t60 57.58 22.12 7.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.807 0.843 . . . . 0.0 112.204 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.34 134.78 56.95 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -77.16 119.29 20.64 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 122.285 -0.26 . . . . 0.0 110.729 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 74.6 mtm -83.57 152.69 24.73 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.148 0.499 . . . . 0.0 112.107 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -73.6 166.39 23.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.123 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -146.22 145.04 22.79 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 122.176 0.19 . . . . 0.0 110.946 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.59 -34.02 3.64 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.174 2.583 . . . . 0.0 112.091 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -152.29 4.57 0.39 Allowed 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -69.18 146.46 44.46 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 -176.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.13 -18.46 21.07 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.841 3.027 . . . . 0.0 111.4 178.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -151.22 151.74 29.87 Favored Pre-proline 0 N--CA 1.455 -0.206 0 N-CA-C 114.598 1.332 . . . . 0.0 114.598 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.15 162.97 40.3 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.953 2.435 . . . . 0.0 110.849 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -129.91 142.31 50.67 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 103.348 -2.834 . . . . 0.0 103.348 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.6 OUTLIER -85.08 139.06 32.02 Favored 'General case' 0 CA--C 1.528 0.135 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -176.52 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 4.6 tt -85.22 145.79 27.4 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.47 151.92 51.84 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.044 -0.663 . . . . 0.0 111.036 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.62 165.14 37.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.583 0.552 . . . . 0.0 111.678 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 23.0 p -163.78 175.81 10.13 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.192 0.997 . . . . 0.0 110.257 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -58.89 125.49 23.77 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.414 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 35.6 t -82.17 152.07 26.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -171.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.3 t -118.26 12.71 13.53 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 169.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.05 161.3 24.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.826 0.85 . . . . 0.0 111.907 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -92.08 -3.2 56.05 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.414 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -152.84 169.98 21.46 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 123.84 0.856 . . . . 0.0 110.477 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.49 25.86 0.96 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.644 0.778 . . . . 0.0 110.148 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.502 -175.947 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.538 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.688 1 O4'-C1'-N19 112.379 4.179 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.647 0 C5'-C4'-C3' 110.406 -3.396 . 0.465 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.555 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.939 1 O4'-C1'-N19 112.552 4.352 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.98 0 C5'-C4'-C3' 111.357 -2.762 . 0.0 OUTLIER '7D dist 4p' 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 O4'-C1'-N19 112.45 4.25 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.528 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 C5'-C4'-C3' 110.103 -3.598 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 O4'-C1'-N19 110.616 2.416 . 0.012 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C3'-C2'-C1' 104.257 3.064 . 0.014 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.414 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.421 -2.666 0 O4'-C1'-N19 111.282 3.082 . 0.236 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 1 C5'-C4'-C3' 108.669 -4.554 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.278 16.4 t80 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -176.39 175.04 47.38 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 111.691 -0.564 . . . . 0.0 111.691 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -59.49 171.56 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 124.785 3.657 . . . . 0.0 112.969 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -150.0 155.99 40.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.276 0.63 . . . . 0.0 110.019 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.53 160.34 27.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.709 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.13 -0.92 33.68 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 378' ' ' SER . . . . . 0.412 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 36.1 t -155.19 148.58 18.49 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.921 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 379' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 44.2 Cg_exo -60.79 -4.07 3.26 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 124.539 3.493 . . . . 0.0 113.945 176.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 p -139.67 157.22 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.106 0 CA-C-O 121.514 0.673 . . . . 0.0 109.319 -174.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.95 160.71 26.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.76 1.624 . . . . 0.0 109.09 -174.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 17.3 tpt -136.65 133.65 36.45 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 122.566 0.347 . . . . 0.0 110.717 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -126.93 152.68 35.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.493 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.7 m-85 -140.26 173.88 11.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.14 11.81 75.17 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.396 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 47.7 mt -78.74 23.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 117.396 0.598 . . . . 0.0 111.181 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.27 10.5 p30 -74.24 26.85 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -173.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.46 156.55 45.18 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.282 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 25.6 m -68.44 -7.29 30.54 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.422 0.689 . . . . 0.0 112.362 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.27 -14.71 61.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 94.2 mmm -100.99 149.6 23.76 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.516 0.598 . . . . 0.0 111.586 -178.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -157.19 151.03 24.47 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.88 0.872 . . . . 0.0 109.336 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.0 p -59.27 -39.45 82.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -174.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -72.02 -34.82 69.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.316 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -76.09 -48.26 21.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.452 0.301 . . . . 0.0 111.499 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.5 p -67.42 -37.4 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -76.9 -32.06 57.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -171.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -76.2 -32.44 58.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 119.589 1.086 . . . . 0.0 110.114 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.21 -54.62 30.06 Favored 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.8 OUTLIER -76.52 -4.18 41.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 172.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.338 0.073 0 O-C-N 121.912 -0.492 . . . . 0.0 110.428 177.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 402' ' ' LEU . . . . . 0.416 HD12 ' C ' ' A' ' 402' ' ' LEU . 2.9 pp -58.11 -18.23 23.7 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.973 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -82.86 -10.48 58.82 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.94 -156.47 24.84 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 118.345 0.52 . . . . 0.0 112.287 -176.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -96.94 131.61 43.55 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.546 -0.385 . . . . 0.0 111.052 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.51 8.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -119.18 -70.68 0.78 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 14.8 pttp -154.48 168.36 26.97 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.2 p -137.32 149.8 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.187 0.995 . . . . 0.0 110.704 -177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -150.72 121.31 7.45 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.316 0.646 . . . . 0.0 111.51 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -85.21 158.92 20.22 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 13.4 mmt -116.37 133.49 55.95 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.55 ' HE2' " H3'" ' B' ' 4' ' ' ' C' . 32.3 mttp -79.36 -23.79 43.11 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 124.254 1.022 . . . . 0.0 111.619 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.3 t -77.81 -19.63 54.64 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -170.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -113.12 156.96 42.14 Favored Pre-proline 0 CA--C 1.527 0.094 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.32 -15.17 47.23 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.617 2.211 . . . . 0.0 110.451 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.27 106.09 0.2 Allowed Glycine 0 C--N 1.338 0.642 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 175.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.83 157.36 29.06 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.41 0.684 . . . . 0.0 110.044 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.12 156.42 21.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.599 0.237 . . . . 0.0 111.636 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 64.5 mtm -102.49 154.11 19.42 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.338 0.655 . . . . 0.0 109.75 171.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 12.0 t -140.27 115.13 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 122.88 0.472 . . . . 0.0 111.23 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -93.77 133.42 37.16 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 44.3 mtp -154.75 172.43 17.95 Favored 'General case' 0 C--N 1.335 -0.045 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -171.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.69 118.13 8.47 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 168.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -72.4 -33.37 67.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -167.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.17 -88.27 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -71.65 -30.62 65.94 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.17 -32.71 18.48 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.564 -0.855 . . . . 0.0 112.729 -173.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 61.1 t -88.38 -24.08 6.22 Favored 'Isoleucine or valine' 0 C--N 1.343 0.296 0 CA-C-N 119.987 1.267 . . . . 0.0 109.685 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -66.07 -50.82 62.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.408 172.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -64.27 -34.51 78.29 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.23 82.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.5 0.591 . . . . 0.0 110.296 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.1 mt -79.17 -8.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.223 0.609 . . . . 0.0 111.089 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 37.6 m -100.61 -18.79 16.41 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 177.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -125.73 -29.82 3.1 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 -169.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 94.6 mt -134.36 -10.06 2.52 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 120.449 1.477 . . . . 0.0 114.151 -170.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.655 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.2 p-10 -71.38 100.74 2.24 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.8 m-80 76.72 21.44 1.24 Allowed 'General case' 0 N--CA 1.479 1.025 0 O-C-N 117.795 -3.066 . . . . 0.0 112.477 -162.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -79.61 158.44 27.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 170.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.29 46.7 m-85 -72.85 42.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -174.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 441' ' ' MET . . . . . 0.422 ' HG2' ' CD2' ' A' ' 442' ' ' PHE . 16.0 ttt -59.74 145.98 43.14 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.791 -0.568 . . . . 0.0 110.43 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 442' ' ' PHE . . . . . 0.422 ' CD2' ' HG2' ' A' ' 441' ' ' MET 0.289 62.0 m-85 55.92 8.82 0.39 Allowed 'General case' 0 C--O 1.231 0.104 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 72.62 13.58 77.95 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -175.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -133.02 -4.41 3.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.672 0.736 . . . . 0.0 112.19 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 62.99 150.99 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.439 1.496 . . . . 0.0 114.069 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.55 110.4 7.19 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 171.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.5 m120 -65.61 130.33 42.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 115.885 -2.007 . . . . 0.0 112.061 -171.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.655 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.426 1.9 t -127.62 150.08 33.14 Favored 'Isoleucine or valine' 0 C--N 1.362 1.145 0 C-N-CA 113.031 -3.468 . . . . 0.0 116.249 169.136 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.7 t -161.04 172.38 16.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.778 1.231 . . . . 0.0 108.139 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.9 p -71.24 146.7 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' SER . . . . . 0.411 ' HA ' ' N3 ' ' B' ' 2' ' ' ' C' . 17.4 t -80.47 155.77 26.89 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 122.861 0.464 . . . . 0.0 111.192 177.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.517 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 62.9 pttt -103.43 -4.01 24.66 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 121.959 0.104 . . . . 0.0 111.068 177.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -82.93 156.18 67.43 Favored Pre-proline 0 N--CA 1.455 -0.181 0 C-N-CA 123.038 0.535 . . . . 0.0 110.276 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -74.84 -37.75 2.01 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.89 2.394 . . . . 0.0 112.144 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.89 163.16 11.57 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.511 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.7 mt -82.3 138.76 18.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 45.8 mmm -102.2 123.65 42.56 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 122.67 0.388 . . . . 0.0 110.506 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -73.7 153.47 48.69 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.19 2.593 . . . . 0.0 109.374 174.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.8 -123.81 1.39 Allowed Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.907 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -72.49 163.85 27.35 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.914 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 470' ' ' SER . 97.5 p -151.21 176.22 11.41 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.123 0.969 . . . . 0.0 109.351 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -136.93 7.08 2.93 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.335 -0.228 . . . . 0.0 111.127 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.55 -172.71 55.14 Favored Glycine 0 CA--C 1.526 0.734 0 O-C-N 122.202 -0.311 . . . . 0.0 112.47 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 75.2 mt -144.92 170.09 16.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.761 1.224 . . . . 0.0 109.586 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -70.09 -28.81 65.71 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.001 -0.437 . . . . 0.0 111.129 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -120.62 9.71 10.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -142.05 164.3 26.86 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 91.8 p -94.51 -22.56 18.16 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.592 0.357 . . . . 0.0 111.94 -176.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.5 t -127.01 146.88 50.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.878 0.471 . . . . 0.0 110.328 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' SER . . . . . 0.423 ' H ' ' HB2' ' A' ' 461' ' ' SER . 89.0 p -88.65 9.54 23.83 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.779 0.832 . . . . 0.0 110.838 176.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -141.34 150.7 42.81 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.002 1.321 . . . . 0.0 114.328 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -155.93 148.07 23.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.992 0.36 . . . . 0.0 111.099 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -100.74 146.35 27.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -140.38 1.45 1.77 Allowed 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 89.8 p -66.28 -19.35 65.79 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.337 0.655 . . . . 0.0 112.039 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -114.03 2.86 15.11 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.512 0.725 . . . . 0.0 111.152 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -76.15 150.03 37.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.976 0.417 . . . . 0.0 111.611 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' ARG . . . . . 0.411 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 60.5 ttt180 -81.44 -11.88 59.1 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.538 0.735 . . . . 0.0 110.656 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -66.22 -18.12 65.16 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -63.33 131.1 47.19 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.718 0.407 . . . . 0.0 110.457 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.2 tpt85 -80.93 -33.77 33.83 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.318 62.9 m-85 -98.0 9.14 43.52 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 117.889 2.551 . . . . 0.0 117.889 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 28.2 m -75.53 -3.58 34.99 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.04 147.72 61.86 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -71.7 -24.77 21.29 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.269 2.646 . . . . 0.0 111.466 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -82.87 -25.78 32.21 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.003 0.365 . . . . 0.0 110.601 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -80.07 -43.94 20.93 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.143 -0.348 . . . . 0.0 110.185 173.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -58.76 -18.63 33.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.02 -19.24 44.31 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -124.05 8.13 8.62 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -65.13 154.11 38.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.135 0.425 . . . . 0.0 111.448 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.406 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 10.9 ptp180 -151.42 137.07 17.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.8 mm -141.55 140.57 31.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.058 0 C-N-CA 123.526 0.73 . . . . 0.0 109.39 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -149.42 169.28 21.23 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.07 0.948 . . . . 0.0 109.948 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -60.15 152.92 59.87 Favored Pre-proline 0 N--CA 1.455 -0.185 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.37 156.12 61.92 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.996 2.464 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 44.3 t -154.83 175.77 13.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.7 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -83.66 -4.86 58.95 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.283 -0.26 . . . . 0.0 110.423 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -94.01 138.2 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 176.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.45 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 82.9 mt -126.31 153.7 44.48 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.268 0.627 . . . . 0.0 109.855 175.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -124.0 131.1 53.52 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -123.93 158.41 32.05 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 -176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -143.75 150.59 38.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -174.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 50.93 57.09 7.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.748 1.219 . . . . 0.0 112.728 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.12 160.58 25.51 Favored Pre-proline 0 N--CA 1.454 -0.251 0 C-N-CA 123.594 0.758 . . . . 0.0 110.265 175.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.46 152.1 27.81 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.265 2.643 . . . . 0.0 112.535 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.57 -16.51 63.89 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.872 0.469 . . . . 0.0 111.934 -177.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -122.94 25.88 8.38 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.876 0.87 . . . . 0.0 110.751 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -64.61 -13.91 15.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.647 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.5 OUTLIER -54.81 -177.41 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -165.414 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.647 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.46 -39.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -169.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.0 mt-10 -59.74 -43.65 94.16 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 172.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.96 -28.78 21.25 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 122.181 2.264 . . . . 0.0 106.873 -174.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -66.98 -33.34 75.36 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -76.53 -42.19 44.03 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -73.2 -26.34 61.12 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 75.6 mt -76.9 -41.33 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.162 0.437 . . . . 0.0 110.902 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 89.8 m -68.34 -35.09 77.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.178 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -69.45 -38.49 77.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -71.1 -27.74 63.81 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.509 0.323 . . . . 0.0 111.533 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.8 mt -93.53 -4.1 51.64 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.8 0.44 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.07 32.56 58.4 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.943 -0.473 . . . . 0.0 112.626 175.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.6 m -127.03 164.68 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 117.554 0.677 . . . . 0.0 111.585 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.52 142.9 57.36 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -83.58 153.8 65.08 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.25 146.66 76.56 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 123.017 2.478 . . . . 0.0 110.729 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.1 t -85.01 -15.82 42.88 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.0 t -150.32 153.08 35.47 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.808 0.443 . . . . 0.0 109.878 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 72.8 t -141.67 145.3 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 123.39 0.676 . . . . 0.0 109.91 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -145.81 138.12 25.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.352 0.661 . . . . 0.0 109.365 176.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 18.4 t -141.77 140.16 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 C-N-CA 123.667 0.787 . . . . 0.0 110.393 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -155.36 169.08 25.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 -176.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.3 p -79.53 170.47 16.52 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.806 0.842 . . . . 0.0 111.485 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 82.68 -174.38 53.04 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.941 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 62.7 -19.44 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.151 1.78 . . . . 0.0 113.86 -177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 43.8 t -161.67 157.93 25.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 110.228 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -116.96 -7.77 11.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.505 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -88.14 -34.8 17.74 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 123.363 0.665 . . . . 0.0 112.237 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 4.0 m -160.59 170.68 20.38 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.016 0.526 . . . . 0.0 111.283 -173.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.4 t -79.89 165.5 22.61 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.44 0.696 . . . . 0.0 111.567 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.6 m -147.89 161.8 40.57 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.413 1.085 . . . . 0.0 109.588 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.56 -170.6 43.74 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.963 -178.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -119.16 159.96 23.01 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.943 0.897 . . . . 0.0 110.356 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.2 mt -141.46 159.79 41.49 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 108.94 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -150.26 149.22 29.86 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 117.782 0.264 . . . . 0.0 111.355 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' TRP . . . . . 0.45 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 13.0 m-90 -124.42 171.91 9.57 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 124.986 1.314 . . . . 0.0 112.48 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -74.48 -12.38 60.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.389 0.276 . . . . 0.0 110.478 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.5 t -157.51 156.06 31.37 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 121.707 -0.62 . . . . 0.0 111.135 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -23.24 63.45 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 122.256 -0.278 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 51.3 m -78.22 -25.29 46.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -78.09 -32.23 50.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.54 0.336 . . . . 0.0 110.708 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.07 -25.56 58.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.334 -0.228 . . . . 0.0 110.431 175.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 60.1 tp -74.66 -41.58 60.04 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.274 -0.266 . . . . 0.0 110.962 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.77 -35.74 75.16 Favored 'General case' 0 N--CA 1.456 -0.145 0 O-C-N 121.965 -0.459 . . . . 0.0 109.903 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.95 -23.57 55.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 177.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.84 -39.44 90.79 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.89 -37.35 88.08 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.339 27.7 m-85 -84.47 -4.59 59.02 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 118.85 2.907 . . . . 0.0 118.85 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 85.5 mt -122.15 -22.0 5.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.049 0.84 . . . . 0.0 113.09 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -70.85 139.17 50.77 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 119.369 0.986 . . . . 0.0 110.388 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 58.91 12.78 2.47 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.645 1.178 . . . . 0.0 112.968 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.268 36.6 t80 -71.25 140.8 50.52 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -72.2 137.8 47.14 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.156 -0.34 . . . . 0.0 111.704 -175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.9 mtm -83.41 145.28 29.08 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 122.356 0.263 . . . . 0.0 110.802 177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -81.07 166.25 20.91 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -148.79 149.57 30.87 Favored Pre-proline 0 CA--C 1.53 0.181 0 C-N-CA 122.644 0.378 . . . . 0.0 110.803 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -74.13 -27.97 11.27 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 112.112 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 37.7 p30 -160.3 8.78 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -68.01 149.46 50.27 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.04 -26.05 13.35 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.622 2.882 . . . . 0.0 111.489 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -154.9 148.04 18.26 Favored Pre-proline 0 CA--C 1.529 0.154 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.87 164.98 27.11 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.902 3.068 . . . . 0.0 111.96 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -130.0 142.3 50.65 Favored 'General case' 0 C--O 1.23 0.069 0 N-CA-C 102.618 -3.104 . . . . 0.0 102.618 173.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.262 0.7 OUTLIER -74.64 138.31 42.82 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.7 tt -89.59 147.1 24.12 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.34 158.53 43.88 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.574 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.93 169.36 23.67 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.232 0.539 . . . . 0.0 111.041 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 51.5 t -155.91 164.07 38.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.445 1.098 . . . . 0.0 109.377 -175.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -57.36 121.07 9.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 174.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.461 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 41.5 t -75.79 144.6 41.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -169.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 t -112.25 13.52 20.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.88 -1.054 . . . . 0.0 113.684 169.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.28 162.92 13.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.242 1.017 . . . . 0.0 111.909 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -87.35 -3.07 59.02 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.967 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -177.52 176.57 1.26 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.32 1.048 . . . . 0.0 110.081 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -137.19 23.3 3.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.657 0.783 . . . . 0.0 110.917 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.129 -1.415 . . . . 0.0 111.09 -177.195 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.493 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.751 1 O4'-C1'-N19 112.68 4.48 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.517 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C5'-C4'-C3' 110.962 -3.025 . 0.436 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.444 " O5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.78 0 C3'-C2'-C1' 104.892 3.769 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . 0.55 " H3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.417 -2.969 1 P-O3'-C3' 125.998 5.248 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . 0.482 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.939 1 O4'-C1'-N19 112.81 4.61 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.519 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 C5'-C4'-C3' 110.029 -3.647 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.411 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.418 -2.922 0 C5'-C4'-C3' 111.558 -2.628 . 0.01 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C3'-C2'-C1' 104.821 3.69 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.461 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.765 0 O4'-C1'-N19 111.207 3.007 . 0.221 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.62 1 C5'-C4'-C3' 108.802 -4.465 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.262 51.5 m-85 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.12 -174.31 44.31 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.63 170.49 16.3 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 124.16 3.24 . . . . 0.0 111.166 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -151.93 156.4 40.0 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.233 0.613 . . . . 0.0 110.376 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.21 157.45 37.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.676 0.39 . . . . 0.0 110.836 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -83.35 6.69 19.02 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 30.0 t -154.28 145.05 16.11 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.119 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.0 Cg_exo -62.36 -7.39 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.911 3.074 . . . . 0.0 112.686 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.41 154.43 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -173.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.2 tt -132.36 154.55 49.64 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.76 1.624 . . . . 0.0 108.103 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 13.9 tpt -134.95 136.49 42.3 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.308 0.243 . . . . 0.0 110.949 -174.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -130.62 151.59 36.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -175.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.479 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.0 m-85 -137.2 172.74 12.54 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.54 11.11 80.66 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.843 -0.421 . . . . 0.0 112.881 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.5 mt -77.97 28.04 0.18 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.802 0.801 . . . . 0.0 112.25 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.42 -39.17 91.8 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.61 148.69 51.56 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.094 0.473 . . . . 0.0 111.147 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.6 p -70.61 -6.72 38.84 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.887 0.875 . . . . 0.0 113.008 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -78.54 -13.45 59.82 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.61 0.364 . . . . 0.0 111.611 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 70.0 mmm -84.69 148.98 26.11 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -163.03 162.21 25.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 16.6 p -59.68 -32.31 70.37 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 122.112 -0.368 . . . . 0.0 111.267 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -73.29 -30.71 63.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 395' ' ' ARG . 1.0 OUTLIER -74.27 -51.67 14.62 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.463 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 12.5 m -65.03 -39.0 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.875 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.675 ' CE1' HG13 ' A' ' 406' ' ' VAL 0.358 1.9 m-85 -67.85 -51.89 43.04 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 175.678 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -58.08 -36.34 72.71 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.255 -173.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 28.5 t -60.4 -64.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.334 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.504 5.3 p90 -76.51 -5.82 49.17 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 118.226 2.676 . . . . 0.0 118.226 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.62 -32.42 53.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.998 0.519 . . . . 0.0 110.036 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -59.2 -17.73 30.25 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.008 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -89.87 -17.5 27.94 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.73 179.36 44.32 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 118.494 0.588 . . . . 0.0 112.941 -176.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -75.33 146.74 40.7 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -175.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.675 HG13 ' CE1' ' A' ' 397' ' ' PHE . 24.1 t -114.15 163.35 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.979 1.311 . . . . 0.0 113.206 -172.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.483 ' N ' HG12 ' A' ' 406' ' ' VAL . 64.1 mm-40 -132.87 -66.89 0.65 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.192 -0.432 . . . . 0.0 111.726 174.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -153.31 156.51 38.51 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.745 0.702 . . . . 0.0 112.833 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 409' ' ' VAL . . . . . 0.535 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.8 p -141.43 148.03 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 174.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -153.5 123.88 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.617 0.246 . . . . 0.0 111.312 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -74.76 162.37 28.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 66.4 mtm -135.11 126.67 28.8 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 121.347 0.594 . . . . 0.0 112.118 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -5.58 54.65 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 124.509 1.124 . . . . 0.0 111.801 176.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 91.6 p -77.96 -4.02 44.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.759 0.424 . . . . 0.0 111.208 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.429 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.5 mmtm -138.49 158.51 70.35 Favored Pre-proline 0 CA--C 1.529 0.159 0 C-N-CA 124.492 1.117 . . . . 0.0 109.484 178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.32 -13.68 40.93 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.149 2.566 . . . . 0.0 111.614 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.32 99.27 0.12 Allowed Glycine 0 C--N 1.336 0.534 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 175.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.94 156.76 35.1 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.814 0.446 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -155.95 146.28 21.68 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 111.219 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 81.4 mtp -88.61 147.84 24.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.1 t -142.13 118.5 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -102.34 134.17 46.06 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 70.0 mtp -153.71 173.91 15.21 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.472 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.58 116.96 7.38 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -72.25 -33.24 67.36 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -167.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.83 -87.35 0.02 OUTLIER Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -74.31 -24.42 59.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.93 -34.92 16.74 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.974 -176.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 69.9 t -84.84 -25.04 7.02 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 118.573 -1.251 . . . . 0.0 109.041 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -66.66 -54.29 24.72 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.913 0.324 . . . . 0.0 111.647 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -64.3 -37.21 86.7 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.52 -35.13 77.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.239 0.472 . . . . 0.0 110.786 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.67 -10.68 12.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.523 0.329 . . . . 0.0 110.919 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 58.6 m -96.76 -20.31 18.31 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -125.61 -31.48 2.97 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.483 HD23 HD22 ' A' ' 439' ' ' ASN . 90.8 mt -134.26 -7.26 2.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.333 1.424 . . . . 0.0 114.299 -169.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.1 p-10 -71.17 100.94 2.16 Favored 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 -170.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.2 m-80 76.92 21.23 1.18 Allowed 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 123.97 3.077 . . . . 0.0 112.156 -162.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 439' ' ' ASN . . . . . 0.483 HD22 HD23 ' A' ' 436' ' ' LEU . 55.7 t30 -84.76 159.44 20.47 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 169.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -75.85 138.8 41.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -160.25 145.58 14.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.566 0.746 . . . . 0.0 109.081 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 60.06 15.57 5.22 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.07 11.41 84.46 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -133.94 -161.44 1.14 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.608 1.563 . . . . 0.0 108.47 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.16 151.14 50.39 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 121.963 -0.461 . . . . 0.0 110.683 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -130.34 91.12 3.04 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.6 m120 -58.93 128.21 36.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 115.863 -2.018 . . . . 0.0 111.721 -173.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.42 1.9 t -128.21 150.47 33.98 Favored 'Isoleucine or valine' 0 C--N 1.367 1.348 0 C-N-CA 113.113 -3.435 . . . . 0.0 116.076 170.157 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 48.6 t -159.94 167.84 27.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.298 1.439 . . . . 0.0 108.618 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -70.74 148.93 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 21.4 t -85.01 158.13 20.56 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.783 0.433 . . . . 0.0 111.497 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.401 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 64.1 pttt -107.44 -1.33 21.57 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.386 0.275 . . . . 0.0 111.45 176.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -85.13 149.01 51.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.792 0.437 . . . . 0.0 110.621 175.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.47 -33.57 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.211 2.607 . . . . 0.0 112.542 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.07 157.79 11.71 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.064 0.393 . . . . 0.0 111.715 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 81.2 mt -83.39 145.23 8.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.4 mtp -114.75 126.98 27.26 Favored Pre-proline 0 CA--C 1.532 0.256 0 O-C-N 122.342 -0.224 . . . . 0.0 110.844 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.13 173.6 14.15 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 124.134 3.223 . . . . 0.0 110.286 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 136.63 -107.78 0.62 Allowed Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.034 -0.827 . . . . 0.0 111.034 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.37 158.34 35.96 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.326 0.65 . . . . 0.0 111.054 -177.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 40.6 t -161.1 163.81 31.15 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.8 0.84 . . . . 0.0 109.466 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -130.56 0.41 4.45 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.03 -177.3 54.37 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 122.934 0.302 . . . . 0.0 112.491 -178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.5 mt -143.7 157.75 44.17 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 124.343 1.057 . . . . 0.0 109.338 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 465' ' ' GLU . 10.5 pm0 -71.82 -10.22 59.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.779 0.431 . . . . 0.0 112.073 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -120.48 20.25 11.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.323 0.649 . . . . 0.0 110.237 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -168.35 -151.74 7.27 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.0 t -133.05 -16.1 2.52 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.8 p -127.06 146.82 50.23 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.374 0.669 . . . . 0.0 111.4 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 93.1 p -92.44 -0.11 57.39 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.862 0.465 . . . . 0.0 110.434 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -126.81 144.96 50.81 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -155.37 156.68 35.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.257 0.2 OUTLIER -136.69 142.74 43.15 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -129.24 12.33 6.03 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 32.2 t -64.04 -25.14 67.98 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.465 0.706 . . . . 0.0 112.013 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -114.0 3.84 15.49 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.351 0.661 . . . . 0.0 111.62 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 45.4 t -75.82 153.6 36.77 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 111.687 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' ARG . . . . . 0.441 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 54.4 ttt180 -83.42 -14.48 52.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.259 0.624 . . . . 0.0 110.717 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -63.24 -22.29 66.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.121 0.568 . . . . 0.0 112.255 -174.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -58.03 130.83 48.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -68.88 -33.84 74.45 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -170.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.413 56.9 m-85 -98.0 17.35 18.53 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.1 t -61.58 -25.73 67.51 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -172.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.57 151.84 76.72 Favored Pre-proline 0 C--O 1.232 0.14 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -177.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.09 -15.66 39.77 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.006 2.471 . . . . 0.0 109.872 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.8 -32.73 60.0 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -80.6 -47.09 14.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 174.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.78 -21.43 65.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.94 -22.55 55.86 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.22 -0.3 . . . . 0.0 111.647 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -124.05 -1.81 8.24 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -60.25 153.93 21.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.425 0.557 . . . . 0.0 111.655 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -152.86 147.34 25.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.5 mm -135.82 147.55 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 C-N-CA 123.252 0.621 . . . . 0.0 109.578 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -156.56 160.54 39.56 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.019 0.528 . . . . 0.0 110.044 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -61.01 155.09 56.78 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.749 0.42 . . . . 0.0 109.999 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.68 146.67 89.13 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.099 2.533 . . . . 0.0 111.065 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 92.5 p -151.48 176.66 11.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.552 0.741 . . . . 0.0 109.627 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -83.71 -2.14 55.59 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.03 142.93 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 123.199 0.6 . . . . 0.0 112.124 175.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.2 tp -137.69 151.75 48.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -124.22 149.99 45.77 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.783 0.833 . . . . 0.0 109.149 -177.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -142.11 159.9 41.29 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.612 0.72 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -149.69 160.04 43.85 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 102.719 -3.067 . . . . 0.0 102.719 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 58.45 57.39 3.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.327 -0.233 . . . . 0.0 111.472 -174.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -123.17 148.51 54.9 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 122.589 0.356 . . . . 0.0 111.202 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.24 155.47 29.45 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.67 2.913 . . . . 0.0 112.794 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.16 -16.38 63.97 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.324 0.649 . . . . 0.0 111.724 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -120.33 20.95 11.85 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.69 0.796 . . . . 0.0 111.183 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.58 -13.91 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.82 -177.3 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -166.158 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -24.05 -40.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.6 mt-10 -58.53 -46.22 87.27 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.289 -1.338 . . . . 0.0 114.449 173.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -87.93 -27.96 21.8 Favored 'General case' 0 C--N 1.351 0.635 0 CA-C-N 122.653 2.479 . . . . 0.0 106.669 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -63.7 -38.07 89.72 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -75.6 -42.7 51.19 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -75.07 -20.91 59.29 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.132 -177.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -77.29 -39.92 28.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 118.268 0.486 . . . . 0.0 110.032 175.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.7 m -69.02 -31.39 70.17 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 122.137 -0.352 . . . . 0.0 110.838 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -72.7 -32.93 66.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.42 0.288 . . . . 0.0 110.692 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -71.74 -27.72 63.18 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.76 -5.96 37.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.818 0.281 . . . . 0.0 111.68 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.93 -7.83 8.91 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 123.678 0.656 . . . . 0.0 113.362 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.2 m -77.34 174.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 118.41 1.105 . . . . 0.0 112.784 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.73 164.52 6.07 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 123.295 0.638 . . . . 0.0 111.922 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -127.16 150.14 71.45 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.587 0.755 . . . . 0.0 109.281 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.11 154.68 69.92 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.095 2.53 . . . . 0.0 111.631 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.9 t -89.33 -17.11 29.56 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 17.3 t -155.48 155.27 33.17 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.523 0.329 . . . . 0.0 110.208 177.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.5 m -141.79 155.22 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -147.56 141.2 25.57 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.597 0.759 . . . . 0.0 109.473 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.33 141.91 29.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.302 0.641 . . . . 0.0 111.796 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -155.23 167.57 29.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -91.02 175.14 7.06 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.917 0.887 . . . . 0.0 110.785 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 95.26 177.07 37.55 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 123.591 0.615 . . . . 0.0 111.71 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 49.7 13.34 0.09 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.701 2.0 . . . . 0.0 114.432 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -160.85 157.65 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 123.797 0.839 . . . . 0.0 109.766 177.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -117.09 6.17 12.86 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -141.22 -10.62 0.96 Allowed 'General case' 0 C--N 1.341 0.198 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 45.2 t -154.31 163.85 39.5 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.463 0.574 . . . . 0.0 111.707 -170.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 60.1 p -90.11 173.63 8.07 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 111.349 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.5 m -145.72 165.8 27.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.595 1.158 . . . . 0.0 108.786 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.56 -174.27 46.06 Favored Glycine 0 CA--C 1.525 0.661 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.959 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.82 161.3 22.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.792 0.837 . . . . 0.0 110.299 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.1 mt -140.64 161.57 37.45 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.885 1.274 . . . . 0.0 108.784 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -148.05 149.76 32.68 Favored 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.936 0.346 . . . . 0.0 111.936 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -127.48 172.14 10.96 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.638 1.575 . . . . 0.0 112.333 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.21 -9.99 59.16 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.4 t -161.38 158.45 26.89 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.092 0.557 . . . . 0.0 110.339 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -73.52 -19.87 60.81 Favored 'General case' 0 CA--C 1.527 0.074 0 O-C-N 122.294 -0.254 . . . . 0.0 111.175 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 86.7 p -79.83 -25.48 40.78 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.92 0.327 . . . . 0.0 110.158 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -76.81 -35.85 57.33 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.323 0.249 . . . . 0.0 111.173 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.32 62.14 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 36.0 tp -73.89 -41.48 62.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.895 0.478 . . . . 0.0 110.12 178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -63.07 -47.07 84.49 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.061 0.457 . . . . 0.0 110.551 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -26.1 63.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 177.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.4 -38.9 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -63.78 -40.46 98.49 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.355 30.1 m-85 -91.13 -3.66 56.88 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 119.362 3.097 . . . . 0.0 119.362 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 74.5 mt -120.3 -4.86 9.92 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.498 1.045 . . . . 0.0 113.482 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -74.66 143.61 44.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.344 0.974 . . . . 0.0 108.54 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 58.07 19.28 5.87 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.591 0.757 . . . . 0.0 112.331 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -71.31 155.47 40.63 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -177.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -70.54 157.9 37.07 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.2 mtm -126.66 152.71 46.37 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.187 0.595 . . . . 0.0 111.917 173.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -74.83 161.0 29.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 169.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -153.61 118.01 2.76 Favored Pre-proline 0 CA--C 1.531 0.247 0 O-C-N 121.991 -0.443 . . . . 0.0 110.817 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -80.6 -16.37 10.5 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.32 2.68 . . . . 0.0 111.864 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.01 -7.8 58.98 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 173.68 170.65 37.38 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.94 -21.14 21.31 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.698 2.932 . . . . 0.0 111.6 -178.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -82.62 131.74 54.1 Favored Pre-proline 0 N--CA 1.454 -0.232 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -83.57 169.25 12.35 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.616 2.877 . . . . 0.0 111.143 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -130.03 142.32 50.63 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 102.834 -3.024 . . . . 0.0 102.834 172.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -76.65 137.14 39.25 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 116.316 1.969 . . . . 0.0 116.316 -175.518 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.7 tt -87.42 150.03 24.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.437 1.095 . . . . 0.0 108.625 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -141.43 153.95 45.3 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.48 161.44 40.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.938 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.5 p -163.27 171.28 16.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.281 0.633 . . . . 0.0 111.626 -175.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -54.34 121.67 8.76 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.413 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 39.4 t -80.52 149.04 30.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -169.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 1.0 OUTLIER -111.68 9.22 20.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 169.545 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.41 168.75 15.4 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.261 1.025 . . . . 0.0 111.801 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -95.47 -3.12 47.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -175.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.74 178.03 4.24 Favored 'General case' 0 C--N 1.338 0.086 0 C-N-CA 123.346 0.659 . . . . 0.0 110.216 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.2 31.49 1.37 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.776 0.43 . . . . 0.0 111.768 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.252 1.192 0 CA-C-O 117.779 -1.105 . . . . 0.0 110.942 -178.879 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.479 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.692 1 O4'-C1'-N19 112.718 4.518 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.401 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 C5'-C4'-C3' 110.645 -3.237 . 0.428 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.702 2 C5'-C4'-C3' 106.239 -6.174 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 1 C5'-C4'-C3' 109.23 -4.18 . 0.01 2u . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.912 1 O4'-C1'-N19 114.009 5.809 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.486 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C5'-C4'-C3' 109.77 -3.82 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.441 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 O4'-C1'-N19 111.978 3.778 . 0.037 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C3'-C2'-C1' 104.566 3.407 . 0.107 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.413 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C5'-C4'-C3' 111.516 -2.656 . 0.279 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 2 C5'-C4'-C3' 108.113 -4.925 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 372' ' ' TYR . . . . . 0.523 ' N ' ' HH ' ' A' ' 427' ' ' TYR 0.339 6.3 p90 . . . . . 0 N--CA 1.473 0.675 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -77.3 152.33 39.67 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -62.14 151.72 80.22 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.705 2.937 . . . . 0.0 111.943 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -78.2 155.41 30.38 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.952 0.501 . . . . 0.0 110.017 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -71.93 155.47 40.32 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.808 0.337 . . . . 0.0 110.714 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -84.59 7.82 18.86 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 378' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 38.3 t -151.6 143.49 16.09 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 122.051 -0.406 . . . . 0.0 110.947 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 379' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 31.3 Cg_exo -63.12 -1.39 2.86 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.292 3.328 . . . . 0.0 113.976 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.4 p -143.01 156.24 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-O 121.809 0.814 . . . . 0.0 109.202 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.54 164.17 24.37 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.078 1.751 . . . . 0.0 107.825 -177.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.1 ttt -144.13 138.64 28.32 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.816 0.735 . . . . 0.0 111.855 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.7 154.54 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 C-N-CA 124.136 0.974 . . . . 0.0 108.588 -175.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.402 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 7.8 m-85 -141.89 171.8 13.56 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.94 10.63 75.11 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 112.057 -0.417 . . . . 0.0 112.057 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 53.8 mt -79.03 26.51 0.25 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.761 0.78 . . . . 0.0 111.879 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -62.9 -35.57 80.49 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.455 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.7 pm0 -67.19 150.64 48.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.2 p -69.81 -7.17 37.63 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 123.687 0.795 . . . . 0.0 112.705 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -79.12 -7.39 58.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.367 0.667 . . . . 0.0 112.311 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 69.1 mmm -91.27 151.9 20.71 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.632 0.651 . . . . 0.0 111.259 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -159.54 155.51 26.49 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.574 0.75 . . . . 0.0 109.754 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 10.8 p -60.24 -38.36 83.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.29 -30.76 63.62 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -75.87 -43.28 46.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.656 0.382 . . . . 0.0 111.082 -177.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.488 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 1.1 m-85 -62.39 -53.39 55.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.099 2.259 . . . . 0.0 117.099 177.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -60.47 -32.49 71.45 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.351 -1.34 . . . . 0.0 109.787 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 11.0 t -60.92 -62.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.4 OUTLIER -76.54 -8.11 56.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 175.822 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.9 t -73.11 -29.66 63.08 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.917 -0.49 . . . . 0.0 109.951 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 402' ' ' LEU . . . . . 0.429 HD11 ' CE2' ' A' ' 403' ' ' TYR . 2.0 pp -60.18 -16.26 31.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.074 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 403' ' ' TYR . . . . . 0.429 ' CE2' HD11 ' A' ' 402' ' ' LEU . 52.2 m-85 -94.87 -6.86 41.77 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.104 2.261 . . . . 0.0 117.104 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.2 175.49 32.28 Favored Glycine 0 CA--C 1.527 0.844 0 CA-C-N 118.35 0.523 . . . . 0.0 112.85 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -70.35 137.31 50.47 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 111.719 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.488 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 15.1 m -114.03 165.31 9.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 124.959 1.304 . . . . 0.0 109.397 -176.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -139.39 -54.65 0.57 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -151.39 152.46 33.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.792 1.178 . . . . 0.0 112.972 -176.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 13.9 p -141.5 145.12 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 123.424 0.69 . . . . 0.0 109.914 176.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -153.6 128.23 9.37 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.872 0.469 . . . . 0.0 110.673 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -80.5 147.83 30.7 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 117.08 2.252 . . . . 0.0 117.08 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.1 mmt -83.3 128.55 34.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.431 0.692 . . . . 0.0 111.409 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.663 ' HE2' " H3'" ' B' ' 4' ' ' ' C' . 36.6 mttp -79.3 -30.14 42.77 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 122.98 0.512 . . . . 0.0 111.108 173.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 28.4 t -79.77 -19.46 48.6 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.925 0.89 . . . . 0.0 112.956 -174.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -108.84 154.15 41.98 Favored Pre-proline 0 N--CA 1.455 -0.191 0 C-N-CA 123.068 0.547 . . . . 0.0 110.179 -175.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -67.96 -17.54 46.34 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.109 2.54 . . . . 0.0 111.293 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.45 103.68 0.17 Allowed Glycine 0 C--N 1.336 0.576 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -163.74 160.74 22.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.49 0.716 . . . . 0.0 109.385 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.47 143.11 16.06 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 79.4 mtp -81.18 149.55 29.05 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.3 t -142.68 102.05 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -84.51 134.38 34.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 75.0 mtp -153.6 171.46 18.73 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 123.723 0.809 . . . . 0.0 109.716 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.49 114.73 6.39 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 169.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -72.43 -33.87 67.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -166.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -52.49 -89.16 0.01 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 427' ' ' TYR . . . . . 0.523 ' HH ' ' N ' ' A' ' 372' ' ' TYR 0.251 55.5 m-85 -77.93 -20.66 52.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 117.389 2.366 . . . . 0.0 117.389 -176.767 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -89.0 -35.76 16.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 119.021 -1.071 . . . . 0.0 111.673 -176.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.6 t -84.82 -26.67 6.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.221 0 C-N-CA 118.722 -1.191 . . . . 0.0 108.24 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -62.14 -62.88 1.46 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 173.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -65.83 -29.14 69.56 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.34 -36.13 78.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.736 0.698 . . . . 0.0 110.401 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 -11.49 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.907 0.483 . . . . 0.0 110.793 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.8 m -94.53 -21.85 18.6 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -130.13 -19.26 3.21 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -169.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.72 -12.33 2.3 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.669 1.577 . . . . 0.0 114.573 -175.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.51 100.98 2.35 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -169.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.1 m-80 76.91 22.05 1.1 Allowed 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 124.05 3.114 . . . . 0.0 113.21 -162.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.84 159.09 25.17 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.593 -0.692 . . . . 0.0 110.117 167.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.26 137.98 41.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 15.8 ttt -157.77 141.18 15.41 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.256 0.623 . . . . 0.0 109.665 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 58.55 16.65 4.39 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 81.63 11.3 83.18 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -132.66 -161.83 1.17 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.782 1.633 . . . . 0.0 108.373 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.78 149.23 49.06 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.886 -0.509 . . . . 0.0 110.8 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -126.39 82.36 2.07 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.446 0.698 . . . . 0.0 109.417 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.1 m120 -54.41 127.95 29.65 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 115.497 -2.192 . . . . 0.0 112.678 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.0 t -127.77 149.17 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 113.464 -3.294 . . . . 0.0 116.519 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.43 168.55 24.92 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.281 1.432 . . . . 0.0 107.653 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.89 150.07 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.1 t -88.62 157.98 18.4 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.133 0.573 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.447 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 64.6 pttt -105.51 -3.47 22.41 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.446 0.298 . . . . 0.0 111.182 178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -75.49 156.58 85.12 Favored Pre-proline 0 CA--C 1.53 0.207 0 C-N-CA 123.259 0.624 . . . . 0.0 110.467 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.85 -35.47 0.99 Allowed 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.897 2.398 . . . . 0.0 112.193 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.57 167.94 9.47 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.393 0.677 . . . . 0.0 110.399 -175.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 65.5 mt -93.89 136.43 25.49 Favored 'Isoleucine or valine' 0 C--O 1.23 0.063 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 69.7 mmm -85.27 130.66 50.91 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-O 119.719 -0.182 . . . . 0.0 110.685 175.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -77.77 27.82 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.807 3.671 . . . . 0.0 111.341 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -74.54 -143.41 0.86 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.955 0.788 . . . . 0.0 113.535 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -72.53 166.95 21.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.727 0.811 . . . . 0.0 111.366 -174.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -146.11 175.46 10.46 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.928 0.891 . . . . 0.0 110.8 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.539 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 32.3 p90 -141.28 -178.4 5.58 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.734 0.813 . . . . 0.0 108.847 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.82 177.18 45.01 Favored Glycine 0 CA--C 1.528 0.867 0 O-C-N 122.031 -0.418 . . . . 0.0 113.02 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 28.0 mt -140.94 168.61 19.37 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 124.24 1.016 . . . . 0.0 109.745 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -71.78 -31.22 66.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.325 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -120.57 18.47 12.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.768 0.427 . . . . 0.0 110.442 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.28 172.99 42.43 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.495 -0.753 . . . . 0.0 112.444 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 95.0 p -99.77 -16.61 18.04 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.99 136.97 52.98 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.25 0.477 . . . . 0.0 111.013 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 94.8 p -83.63 -0.5 50.84 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.113 0.965 . . . . 0.0 111.634 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.265 4.0 t80 -131.24 149.16 52.69 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -155.27 150.47 26.96 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -177.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.285 0.3 OUTLIER -129.89 140.94 50.88 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 178.149 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.48 7.52 10.1 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 39.3 t -65.34 -19.62 66.04 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.983 0.513 . . . . 0.0 111.764 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -113.91 2.26 15.01 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.126 0.57 . . . . 0.0 111.539 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.1 t -80.74 151.96 28.58 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.67 0.388 . . . . 0.0 111.349 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' ARG . . . . . 0.433 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 57.4 ttt180 -81.64 -13.41 57.97 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.705 0.402 . . . . 0.0 111.191 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -59.52 -23.53 62.89 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -57.35 113.1 1.61 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.25 0.62 . . . . 0.0 109.775 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -75.32 -29.73 60.11 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.31 64.7 m-85 -98.0 15.03 25.31 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 43.8 t -71.34 -18.36 62.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -132.65 151.36 78.01 Favored Pre-proline 0 C--O 1.233 0.216 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.26 -32.51 62.03 Favored 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.345 2.697 . . . . 0.0 112.667 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -78.68 -27.33 45.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.115 0.416 . . . . 0.0 110.496 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -74.44 -41.13 61.37 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 174.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -63.43 -17.06 62.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.35 -0.218 . . . . 0.0 111.386 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -87.16 -10.54 52.43 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -124.02 -10.17 7.66 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -63.83 155.67 29.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -152.61 146.26 25.05 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 44.7 mm -123.21 149.32 26.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 C-N-CA 123.505 0.722 . . . . 0.0 109.516 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -156.02 155.95 33.58 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.823 0.449 . . . . 0.0 109.852 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -59.8 156.94 31.67 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.917 0.487 . . . . 0.0 109.906 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -62.91 142.67 89.25 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.182 1.922 . . . . 0.0 108.905 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.6 t -154.5 167.07 31.28 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.915 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -83.68 -2.54 56.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.802 0.441 . . . . 0.0 110.718 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.33 140.13 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.503 0.721 . . . . 0.0 112.403 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.9 mt -128.85 156.47 43.59 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.065 0.546 . . . . 0.0 110.118 176.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -115.65 150.23 37.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -137.46 154.98 49.82 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -151.57 166.83 29.97 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 102.959 -2.978 . . . . 0.0 102.959 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 56.55 57.53 4.78 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.003 -0.436 . . . . 0.0 111.663 -174.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -133.0 148.92 71.33 Favored Pre-proline 0 N--CA 1.454 -0.248 0 C-N-CA 122.427 0.291 . . . . 0.0 110.61 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.42 161.06 47.38 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.003 2.468 . . . . 0.0 110.917 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.61 -16.38 63.83 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.485 0.314 . . . . 0.0 111.008 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -100.44 12.18 37.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.404 0.682 . . . . 0.0 111.532 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.33 -18.22 23.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.706 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.1 m -55.07 -177.27 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.811 -1.09 . . . . 0.0 113.686 -166.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.706 ' H ' HG22 ' A' ' 510' ' ' THR . 23.4 pt-20 -23.09 -41.18 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -169.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.7 mt-10 -57.86 -47.22 83.35 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 173.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -88.04 -27.91 21.7 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 122.356 2.343 . . . . 0.0 106.296 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.33 -37.27 86.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -75.27 -42.23 55.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.65 -24.22 49.49 Favored 'General case' 0 CA--C 1.526 0.024 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.222 -177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.04 -41.7 52.45 Favored 'Isoleucine or valine' 0 C--N 1.337 0.052 0 CA-C-N 118.864 0.756 . . . . 0.0 109.984 176.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 99.7 m -65.98 -26.99 67.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.056 -0.403 . . . . 0.0 110.853 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -70.17 -41.31 73.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -71.35 -24.46 62.1 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -89.24 -5.96 57.21 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.313 0.245 . . . . 0.0 111.212 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 69.19 -7.45 3.35 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 123.702 0.668 . . . . 0.0 113.867 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.4 m -83.9 172.83 1.0 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-N 118.459 1.129 . . . . 0.0 113.33 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.8 152.05 32.53 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.292 1.037 . . . . 0.0 113.077 -174.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 47.3 mtm105 -95.59 149.92 36.75 Favored Pre-proline 0 CA--C 1.529 0.141 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.828 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -69.74 150.29 68.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.137 2.558 . . . . 0.0 110.658 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -92.19 -14.11 29.55 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.6 t -152.58 155.52 37.53 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.358 0.263 . . . . 0.0 110.716 176.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 61.0 t -145.3 145.68 20.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 123.688 0.795 . . . . 0.0 111.31 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -147.36 142.34 26.98 Favored 'General case' 0 CA--C 1.526 0.056 0 C-N-CA 123.894 0.877 . . . . 0.0 109.334 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.69 143.03 31.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 122.981 0.513 . . . . 0.0 111.218 -176.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.1 p90 -155.67 -178.31 7.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 69.9 m -131.42 177.69 7.3 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 110.858 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.95 -5.78 59.76 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.792 0.711 . . . . 0.0 112.689 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -93.22 -20.34 20.54 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-N 117.886 0.843 . . . . 0.0 111.167 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 36.9 t -164.45 155.27 15.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.23 0.612 . . . . 0.0 110.432 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.98 -7.93 31.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.463 0.305 . . . . 0.0 110.517 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -89.23 -31.52 17.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.5 p -160.83 168.53 24.52 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.458 0.646 . . . . 0.0 112.287 -172.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 29.8 t -81.36 167.22 19.71 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.611 1.164 . . . . 0.0 111.379 178.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -146.72 159.74 43.1 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 124.373 1.069 . . . . 0.0 109.518 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.99 -173.82 45.7 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.84 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -119.27 159.76 23.48 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.413 0.685 . . . . 0.0 110.693 -177.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.7 mt -140.61 159.26 42.58 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.081 1.352 . . . . 0.0 108.414 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.99 149.1 29.18 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.979 -0.451 . . . . 0.0 111.183 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -124.04 171.0 10.1 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 125.027 1.331 . . . . 0.0 112.479 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -73.63 -12.66 60.81 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.803 0.441 . . . . 0.0 111.487 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.7 t -157.19 160.15 38.43 Favored 'General case' 0 C--N 1.339 0.115 0 O-C-N 121.687 -0.633 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.84 -29.89 68.31 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.201 0.2 . . . . 0.0 110.822 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 89.7 p -76.4 -26.01 55.14 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -74.85 -35.42 62.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.336 0.255 . . . . 0.0 110.932 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.04 -37.18 66.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.17 -37.66 78.3 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.236 -0.29 . . . . 0.0 110.247 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -62.0 -45.71 92.42 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.093 0.473 . . . . 0.0 110.264 176.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.6 m -69.9 -28.18 65.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.09 -35.7 81.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.14 -44.82 90.36 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.464 -0.631 . . . . 0.0 111.888 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -89.65 -24.6 21.6 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.33 -18.62 20.63 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -173.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.38 152.36 39.56 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.621 -0.674 . . . . 0.0 110.428 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.49 17.28 4.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.023 1.329 . . . . 0.0 113.182 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -69.75 139.3 53.31 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -75.85 138.9 41.41 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.863 -0.523 . . . . 0.0 111.945 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.3 mtm -83.49 152.66 24.82 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.125 0.488 . . . . 0.0 111.624 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 25.61 2.48 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.175 0.99 . . . . 0.0 113.062 -178.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 -56.24 112.21 4.12 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 118.279 0.49 . . . . 0.0 111.704 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -82.35 -18.9 6.88 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.482 2.788 . . . . 0.0 112.123 -177.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -83.95 -12.82 54.78 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -96.28 156.09 21.16 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.588 -0.605 . . . . 0.0 111.588 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -70.68 -22.71 27.51 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 124.177 3.251 . . . . 0.0 110.583 176.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -153.13 156.27 32.51 Favored Pre-proline 0 N--CA 1.453 -0.297 0 C-N-CA 124.712 1.205 . . . . 0.0 113.933 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 159.77 52.18 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.601 2.201 . . . . 0.0 111.348 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' TYR . . . . . 0.421 ' CE2' ' C5 ' ' C' ' 1' ' ' ' A' . 6.0 m-85 -129.39 142.29 50.84 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 102.542 -3.133 . . . . 0.0 102.542 176.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.276 0.7 OUTLIER -78.15 138.53 38.76 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -176.029 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.47 150.79 25.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.977 1.311 . . . . 0.0 108.203 172.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.06 152.78 46.47 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.986 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 10.8 mt -132.27 164.91 25.37 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.822 0.849 . . . . 0.0 111.144 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 47.6 t -159.17 154.42 25.42 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.742 0.817 . . . . 0.0 109.21 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -59.93 117.06 4.61 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 174.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.487 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 40.3 t -73.0 146.95 45.6 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -169.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -112.32 10.82 19.99 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 169.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.3 162.54 17.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.619 0.768 . . . . 0.0 111.321 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -86.17 -3.8 59.04 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.727 -175.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -176.24 178.07 1.44 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.674 1.19 . . . . 0.0 109.576 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -133.23 16.62 4.1 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.866 0.467 . . . . 0.0 111.682 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.261 179.718 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.402 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.763 0 O4'-C1'-N19 111.863 3.663 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.447 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.873 0 C5'-C4'-C3' 110.841 -3.106 . 0.317 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.54 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C3'-C2'-C1' 104.972 3.857 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . 0.663 " H3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.925 1 P-O3'-C3' 125.367 4.722 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.891 1 O4'-C1'-N19 112.34 4.14 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.559 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.897 0 C3'-C2'-C1' 104.844 3.715 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.433 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C5'-C4'-C3' 110.717 -3.189 . 0.01 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.981 0 C3'-C2'-C1' 104.772 3.635 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.487 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 111.8 3.6 . 0.177 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 1 C5'-C4'-C3' 107.654 -5.231 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.306 37.1 t80 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 159.63 170.69 24.51 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -60.1 159.06 27.42 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 124.042 3.161 . . . . 0.0 111.598 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -155.9 153.68 30.04 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.027 0.442 . . . . 0.0 111.09 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.22 163.4 25.81 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.142 0.577 . . . . 0.0 111.185 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -74.09 -7.11 51.37 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.6 t -159.05 148.26 14.55 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.495 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.61 -14.56 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.349 2.7 . . . . 0.0 110.737 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.61 149.84 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -137.24 152.95 50.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.792 1.237 . . . . 0.0 108.225 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -133.96 133.44 41.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.398 -0.189 . . . . 0.0 110.512 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -129.91 152.04 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.086 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.509 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 4.8 m-85 -140.74 173.13 11.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 -177.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.72 10.71 78.69 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.437 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.6 mt -80.69 25.13 0.44 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.464 0.705 . . . . 0.0 112.201 -178.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -65.38 -39.87 92.78 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -175.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.6 pm0 -67.28 149.66 50.08 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.133 0.492 . . . . 0.0 111.143 -178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 88.0 p -68.26 -8.63 41.07 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -77.71 -20.37 53.67 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 118.116 0.416 . . . . 0.0 111.182 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 64.9 mmm -82.06 147.87 28.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 122.178 -0.326 . . . . 0.0 110.252 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.07 155.78 25.8 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -60.71 -30.5 70.0 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -71.81 -40.03 69.44 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 61.0 mtt85 -76.05 -41.12 51.72 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 -175.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.58 -43.66 77.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -176.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -76.83 -29.54 55.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.429 -0.796 . . . . 0.0 109.198 -169.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -78.84 -30.21 45.08 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 119.991 1.269 . . . . 0.0 110.0 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -54.77 29.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.557 2.4 p90 -76.72 -7.34 55.17 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 172.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.7 t -69.28 -26.39 64.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 78.8 mt -54.4 -24.36 19.48 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -92.94 -11.07 34.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -173.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 170.68 176.87 40.32 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 118.205 0.457 . . . . 0.0 112.199 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -68.61 136.28 52.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.853 0.359 . . . . 0.0 111.683 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.06 165.52 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -119.97 -70.96 0.76 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.449 0.3 . . . . 0.0 111.238 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -154.44 170.68 20.81 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 9.2 p -146.03 149.37 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.369 1.068 . . . . 0.0 110.513 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -155.8 137.86 14.58 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.353 0.661 . . . . 0.0 111.075 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.4 m-85 -88.23 156.53 19.17 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 21.9 mmt -98.38 118.86 36.0 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 122.879 0.472 . . . . 0.0 111.882 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -14.42 59.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.148 0.179 . . . . 0.0 110.686 169.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 98.9 p -84.23 1.3 45.25 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.752 0.821 . . . . 0.0 112.377 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.436 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.4 mmtm -139.38 155.66 72.03 Favored Pre-proline 0 CA--C 1.528 0.115 0 C-N-CA 123.665 0.786 . . . . 0.0 110.134 -177.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -68.34 -16.08 43.15 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.174 2.583 . . . . 0.0 111.647 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.77 93.77 0.09 OUTLIER Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.41 161.55 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.467 0.707 . . . . 0.0 109.329 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.49 151.25 25.91 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.129 0.49 . . . . 0.0 111.958 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 36.8 ttm -96.11 147.29 23.88 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.6 t -141.17 152.46 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -138.56 133.69 32.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 42.6 mtp -152.36 174.17 14.16 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.346 1.058 . . . . 0.0 109.053 -171.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.85 124.25 21.97 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -72.53 -32.26 65.96 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.744 -1.222 . . . . 0.0 114.164 -166.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.07 -90.84 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 O-C-N 124.559 1.162 . . . . 0.0 110.775 -176.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.296 64.7 m-85 -75.85 -20.24 58.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.2 -33.99 15.98 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 118.569 -1.253 . . . . 0.0 111.371 -175.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.6 t -86.97 -26.96 5.89 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 C-N-CA 118.238 -1.385 . . . . 0.0 109.057 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -67.5 -51.37 52.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.651 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -65.49 -35.83 82.06 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.965 -0.46 . . . . 0.0 112.111 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.29 83.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.604 0.638 . . . . 0.0 110.417 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.5 mt -77.13 -14.15 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 122.848 0.459 . . . . 0.0 110.899 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 15.5 m -94.7 -19.78 20.11 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 114.452 1.279 . . . . 0.0 114.452 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -126.07 -27.99 3.21 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.9 mt -134.38 -8.94 2.55 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -172.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.635 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 33.0 p-10 -70.27 105.32 2.94 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -168.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.3 m-80 75.15 22.08 1.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 116.788 -3.695 . . . . 0.0 115.055 -164.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -77.36 161.45 28.03 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.307 -0.871 . . . . 0.0 109.707 167.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -79.62 138.37 37.4 Favored 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 177.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.2 ttt -159.51 136.95 9.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.289 0.636 . . . . 0.0 110.174 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.389 52.0 m-85 57.32 26.65 12.66 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.02 9.79 86.69 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.261 -0.735 . . . . 0.0 111.261 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -135.84 -164.67 1.58 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.019 1.328 . . . . 0.0 108.779 -178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.46 147.22 52.13 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.698 0.285 . . . . 0.0 111.33 -176.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.5 ptm -118.57 75.6 1.03 Allowed 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 124.477 1.111 . . . . 0.0 109.171 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.3 m120 -53.7 127.19 24.71 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 115.979 -1.963 . . . . 0.0 112.265 -173.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.635 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.2 t -126.71 152.06 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 113.537 -3.265 . . . . 0.0 115.877 169.557 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 43.2 t -160.74 165.74 29.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.523 1.529 . . . . 0.0 108.324 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.14 147.93 11.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 O-C-N 121.56 -0.713 . . . . 0.0 112.56 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.4 t -88.14 157.72 18.75 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 122.827 0.451 . . . . 0.0 111.35 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -97.55 -5.66 35.26 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.087 0.155 . . . . 0.0 110.652 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -77.84 152.57 80.2 Favored Pre-proline 0 N--CA 1.456 -0.153 0 C-N-CA 123.546 0.739 . . . . 0.0 111.029 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.56 -36.06 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.363 2.709 . . . . 0.0 112.139 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.99 159.69 9.5 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.358 0.663 . . . . 0.0 110.707 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.23 132.41 32.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 37.0 mmm -100.33 126.24 36.76 Favored Pre-proline 0 N--CA 1.454 -0.24 0 C-N-CA 122.454 0.301 . . . . 0.0 110.707 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.62 153.79 44.03 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.186 2.591 . . . . 0.0 109.102 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 167.81 -127.8 1.62 Allowed Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.86 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -72.45 172.95 9.51 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.1 p -156.36 172.3 18.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.044 0.538 . . . . 0.0 110.215 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -137.16 4.44 2.7 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.0 -176.2 53.93 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 56.0 mt -145.65 168.76 19.9 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.053 0.941 . . . . 0.0 109.916 -178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.4 pm0 -65.3 -31.38 72.49 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.065 0.546 . . . . 0.0 110.364 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -120.5 10.02 11.04 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.47 172.82 30.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.739 -0.545 . . . . 0.0 111.739 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 92.0 p -101.72 -15.03 17.11 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 122.89 0.476 . . . . 0.0 111.997 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.11 145.69 50.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.864 0.465 . . . . 0.0 110.171 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 78.6 p -85.49 10.4 13.1 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.396 0.678 . . . . 0.0 111.301 177.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -138.18 149.9 46.26 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.29 150.98 30.35 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 120.801 0.334 . . . . 0.0 110.485 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -124.09 138.37 54.44 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.156 0.983 . . . . 0.0 113.577 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.23 2.53 5.18 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 95.9 p -66.11 -15.91 63.5 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.123 0.569 . . . . 0.0 112.158 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -113.98 -0.38 14.1 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.05 0.54 . . . . 0.0 111.369 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 68.6 m -79.84 150.83 30.54 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.599 0.36 . . . . 0.0 111.522 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -79.47 -12.56 59.88 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.987 0.515 . . . . 0.0 111.193 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.18 -18.99 62.62 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -176.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -61.75 115.04 3.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -73.06 -31.52 64.45 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.447 0.299 . . . . 0.0 111.59 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.29 61.1 m-85 -97.93 17.4 18.31 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 42.6 t -64.43 -20.9 66.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 0.8 OUTLIER -137.86 151.39 70.28 Favored Pre-proline 0 C--O 1.231 0.129 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -178.386 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.3 Cg_endo -70.55 -23.59 27.01 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.111 2.541 . . . . 0.0 111.923 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -80.13 -20.15 45.61 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.255 0.48 . . . . 0.0 110.705 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -85.73 -39.7 16.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 172.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.96 64.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.761 0.424 . . . . 0.0 111.996 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.27 -21.36 53.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -124.08 7.74 8.59 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.03 156.63 38.32 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.453 0.57 . . . . 0.0 111.913 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.419 ' NH2' " H2'" ' C' ' 4' ' ' ' C' . 10.6 mpt_? -118.6 146.47 44.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.553 0.741 . . . . 0.0 110.728 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.3 mm -143.57 138.29 25.64 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.21 159.3 35.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -58.81 154.91 34.24 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -65.16 146.57 87.04 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.32 2.013 . . . . 0.0 109.073 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -155.95 170.95 20.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.309 0.244 . . . . 0.0 110.636 -173.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -83.7 -1.19 53.56 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.569 0.348 . . . . 0.0 111.034 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.77 137.57 29.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.5 mt -123.32 161.48 24.58 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.232 0.613 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -130.17 143.76 50.97 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.736 1.214 . . . . 0.0 108.316 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.86 163.24 30.69 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.445 0.64 . . . . 0.0 112.067 -177.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -149.31 162.53 39.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 57.1 57.36 4.61 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.736 0.414 . . . . 0.0 111.727 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -121.64 151.27 56.82 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 122.686 0.394 . . . . 0.0 111.989 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.84 152.61 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.585 2.857 . . . . 0.0 112.921 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.61 -16.43 63.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.173 0.589 . . . . 0.0 111.444 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -123.05 25.62 8.44 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.394 0.677 . . . . 0.0 110.696 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.79 -12.59 14.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.657 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.91 -177.31 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.865 -1.065 . . . . 0.0 113.854 -165.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.657 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -26.46 -37.27 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -169.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.3 mt-10 -58.22 -47.38 83.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 117.07 -1.443 . . . . 0.0 114.559 171.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -88.19 -26.7 22.26 Favored 'General case' 0 C--N 1.353 0.718 0 CA-C-N 122.732 2.514 . . . . 0.0 107.113 -173.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -67.63 -34.49 77.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.503 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -75.2 -42.86 54.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -76.19 -21.34 56.58 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.802 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.96 -40.6 26.86 Favored 'Isoleucine or valine' 0 C--N 1.339 0.113 0 CA-C-N 118.423 0.556 . . . . 0.0 109.954 175.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 87.7 m -68.4 -34.59 76.31 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.958 -0.464 . . . . 0.0 110.933 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.16 -38.1 84.88 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -70.54 -28.39 64.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 122.114 -0.366 . . . . 0.0 111.032 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -92.51 -4.12 54.07 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.263 0.625 . . . . 0.0 111.519 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.58 -2.0 59.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.15 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.0 t -77.1 153.55 5.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 118.072 0.936 . . . . 0.0 112.182 178.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -68.36 151.68 46.52 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.399 . . . . 0.0 110.294 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.9 ptt85 -78.07 156.14 79.56 Favored Pre-proline 0 CA--C 1.53 0.2 0 C-N-CA 122.685 0.394 . . . . 0.0 110.365 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.06 154.29 72.93 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.111 2.541 . . . . 0.0 110.386 173.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.3 t -85.39 -17.28 37.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.1 t -156.97 152.72 27.0 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.558 0.343 . . . . 0.0 110.173 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.1 m -143.44 154.73 16.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 123.719 0.808 . . . . 0.0 112.35 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -150.75 144.33 25.05 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.181 0.592 . . . . 0.0 109.973 176.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -138.08 150.73 24.85 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 C-N-CA 123.398 0.679 . . . . 0.0 112.218 177.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -152.83 174.84 13.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.7 t -142.96 168.91 18.59 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.556 0.742 . . . . 0.0 109.624 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 115.15 -16.47 17.74 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 123.857 0.741 . . . . 0.0 111.985 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -80.91 -26.48 36.74 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 117.795 0.797 . . . . 0.0 111.131 175.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.2 t -163.9 157.35 18.58 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.747 0.819 . . . . 0.0 109.686 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -96.99 -6.89 34.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.539 0.336 . . . . 0.0 110.532 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -78.18 -41.54 34.33 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 32.5 t -161.13 163.56 31.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -170.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -90.36 167.32 12.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.096 0.958 . . . . 0.0 111.702 -177.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.3 m -145.44 165.66 27.91 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 124.996 1.318 . . . . 0.0 108.748 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.69 -170.77 43.92 Favored Glycine 0 CA--C 1.525 0.701 0 C-N-CA 120.554 -0.832 . . . . 0.0 113.322 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.03 159.84 26.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.036 0.934 . . . . 0.0 110.228 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.51 156.91 45.7 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 124.588 1.155 . . . . 0.0 109.085 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -148.18 149.38 31.87 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 117.925 0.33 . . . . 0.0 111.664 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.0 m-90 -126.81 172.53 10.3 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 124.828 1.251 . . . . 0.0 112.152 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -76.13 -9.59 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.666 0.386 . . . . 0.0 110.556 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.9 t -158.4 158.93 35.15 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.623 -0.673 . . . . 0.0 111.669 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -69.45 -24.9 63.87 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 122.368 0.267 . . . . 0.0 110.502 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 49.2 m -77.91 -27.49 49.53 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -74.31 -32.15 62.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -77.83 -25.91 49.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.7 tp -77.38 -37.16 52.66 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.199 0.199 . . . . 0.0 111.317 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -75.61 -38.54 58.92 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.591 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.264 0.2 OUTLIER -71.6 -22.28 61.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 12.1 tp -67.91 -37.44 81.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 170.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.11 -30.46 76.93 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.315 11.5 m-85 -101.32 -2.57 30.72 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 84.6 mt -125.05 -3.63 7.56 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.287 0.948 . . . . 0.0 113.29 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -79.88 139.58 37.08 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.739 1.154 . . . . 0.0 109.586 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 56.74 19.37 4.32 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 175.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -77.86 149.96 34.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 104.103 -2.555 . . . . 0.0 104.103 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -78.34 143.38 36.96 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.719 0.408 . . . . 0.0 111.992 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.1 mtm -83.57 152.65 24.75 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 111.259 175.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -81.33 38.67 0.49 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.138 0.975 . . . . 0.0 111.295 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -47.0 109.94 1.17 Allowed Pre-proline 0 CA--C 1.533 0.297 0 C-N-CA 123.893 0.877 . . . . 0.0 112.734 -171.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -86.42 -12.93 5.36 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.824 3.016 . . . . 0.0 111.682 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -84.48 -0.17 51.94 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -173.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -159.78 170.21 35.92 Favored Glycine 0 CA--C 1.526 0.772 0 CA-C-N 118.31 0.505 . . . . 0.0 112.327 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.2 -10.73 24.56 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.952 3.768 . . . . 0.0 112.232 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.254 0.8 OUTLIER -140.6 149.38 56.82 Favored Pre-proline 0 N--CA 1.454 -0.267 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -77.58 164.22 28.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 123.751 2.967 . . . . 0.0 111.675 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -129.93 142.29 50.67 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 172.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.02 141.96 32.76 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -82.3 146.1 29.61 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 172.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.14 148.48 49.76 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 117.829 0.286 . . . . 0.0 110.237 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.3 pp -154.99 165.46 36.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.181 0.515 . . . . 0.0 111.811 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 31.3 p -159.8 174.42 14.51 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.971 0.908 . . . . 0.0 109.887 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -61.04 126.43 27.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.4 t -84.29 156.09 22.11 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -172.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -122.08 11.78 10.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.317 1.047 . . . . 0.0 113.604 170.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.58 162.92 14.59 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.087 0.955 . . . . 0.0 111.659 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -85.73 -3.23 58.84 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -171.65 178.21 3.18 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.027 0.931 . . . . 0.0 109.359 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -132.41 16.43 4.47 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.987 0.515 . . . . 0.0 111.465 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.614 -1.184 . . . . 0.0 110.492 -179.861 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.509 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.762 1 O4'-C1'-N19 112.236 4.036 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 C5'-C4'-C3' 110.314 -3.457 . 0.373 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.567 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.944 0 C3'-C2'-C1' 104.557 3.397 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 1 C5'-C4'-C3' 108.971 -4.353 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.898 1 O4'-C1'-N19 112.754 4.554 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.5 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.752 0 C5'-C4'-C3' 109.632 -3.912 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C5'-C4'-C3' 111.441 -2.706 . 0.08 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.926 0 C3'-C2'-C1' 104.645 3.495 . 0.055 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.419 " H2'" ' NH2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 O4'-C1'-N19 111.657 3.457 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.629 1 C5'-C4'-C3' 108.397 -4.735 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.303 35.7 t80 . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -73.73 167.81 54.29 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.31 176.79 6.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.369 3.38 . . . . 0.0 110.816 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -146.33 158.32 43.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.819 0.448 . . . . 0.0 110.539 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.41 160.65 31.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.623 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -78.95 -3.43 44.89 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.379 0.672 . . . . 0.0 110.576 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -155.12 148.64 18.61 Favored Pre-proline 0 C--O 1.233 0.21 0 O-C-N 121.726 -0.609 . . . . 0.0 112.058 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -61.33 -5.84 5.89 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 124.246 3.297 . . . . 0.0 113.029 172.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 153.33 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.091 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.7 tt -128.07 154.49 45.64 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.655 1.582 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.9 tpt -137.4 133.55 34.9 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 117.847 0.294 . . . . 0.0 110.971 -175.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.54 153.44 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.502 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 2.5 m-85 -146.12 170.48 16.61 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 87.72 6.94 75.83 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.669 -0.517 . . . . 0.0 113.07 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.05 45.28 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.106 0.962 . . . . 0.0 111.372 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -82.04 -13.47 57.29 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -174.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -83.76 147.14 27.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.672 0.389 . . . . 0.0 110.176 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 91.1 p -72.67 -7.32 49.81 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -81.47 -17.4 48.85 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.651 0.38 . . . . 0.0 111.353 -177.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 92.5 mmm -83.66 162.63 20.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.351 0.596 . . . . 0.0 111.487 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -167.74 168.76 12.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.612 1.565 . . . . 0.0 106.79 176.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -61.67 -34.25 75.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.379 0.536 . . . . 0.0 110.95 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -74.74 -29.51 61.19 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -74.23 -51.54 15.09 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 122.127 -0.358 . . . . 0.0 111.052 -175.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.7 p -72.6 -37.61 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -73.37 -32.06 64.29 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.13 -48.37 80.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 118.897 0.771 . . . . 0.0 111.403 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 31.0 t -56.69 -55.63 18.63 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 1.4 p90 -76.52 -5.8 49.11 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 29.0 t -77.4 -34.05 54.9 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.699 -0.626 . . . . 0.0 111.657 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 402' ' ' LEU . . . . . 0.478 HD12 ' C ' ' A' ' 402' ' ' LEU . 2.7 pp -62.66 -12.23 22.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 119.916 -0.714 . . . . 0.0 111.597 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.81 2.77 40.8 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 169.94 -144.38 8.48 Favored Glycine 0 CA--C 1.525 0.688 0 O-C-N 121.805 -0.559 . . . . 0.0 112.008 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -116.17 131.65 56.88 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.9 m -113.94 165.59 8.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -175.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -118.42 -65.95 1.12 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.563 0.345 . . . . 0.0 111.662 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 408' ' ' LYS . . . . . 0.458 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 36.2 mtmm -150.57 169.3 21.87 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.325 0.511 . . . . 0.0 111.914 -173.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.9 p -146.78 147.83 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 123.95 0.9 . . . . 0.0 109.264 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -154.63 140.74 18.44 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.582 0.353 . . . . 0.0 111.118 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.281 5.2 m-85 -94.44 156.52 16.44 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 117.052 2.242 . . . . 0.0 117.052 -178.162 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.4 mmt -93.75 125.17 38.22 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.008 0.523 . . . . 0.0 112.234 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.432 ' HE2' " O3'" ' B' ' 3' ' ' ' A' . 0.2 OUTLIER -79.12 -14.32 59.2 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 124.311 1.044 . . . . 0.0 111.802 176.803 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 90.4 p -97.18 1.25 49.59 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.364 0.666 . . . . 0.0 112.483 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.447 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 46.7 mmtm -131.44 152.81 81.15 Favored Pre-proline 0 CA--C 1.53 0.196 0 C-N-CA 123.165 0.586 . . . . 0.0 110.293 -175.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -71.07 -14.68 32.08 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.303 2.669 . . . . 0.0 111.737 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.21 90.81 0.08 OUTLIER Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.63 156.23 37.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.91 154.01 29.06 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.945 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.2 ptm -107.64 150.01 27.4 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 9.4 t -141.18 130.33 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -173.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -107.18 131.93 53.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 47.6 mtp -153.29 171.29 18.79 Favored 'General case' 0 C--O 1.231 0.092 0 C-N-CA 123.211 0.605 . . . . 0.0 109.377 -172.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.79 115.89 6.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 169.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -72.35 -33.44 67.27 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.78 -87.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -75.07 -25.56 58.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -175.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.35 -36.09 16.8 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.053 -174.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.57 -26.45 6.5 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.042 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -64.43 -53.4 49.01 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 117.981 0.355 . . . . 0.0 111.947 173.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -69.91 -29.18 66.29 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.01 80.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.599 0.636 . . . . 0.0 110.144 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.0 mt -78.6 -15.44 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.147 0.579 . . . . 0.0 110.73 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 45.3 m -91.37 -20.82 21.42 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.453 ' C ' HD22 ' A' ' 436' ' ' LEU . 97.1 m-70 -132.55 -24.35 2.01 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -169.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 435' ' ' HIS . 4.1 mm? -128.91 -12.14 4.75 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.731 1.605 . . . . 0.0 113.78 -172.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.606 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.5 p-10 -71.79 101.07 2.51 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -168.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.56 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 17.3 m-80 78.85 21.82 0.69 Allowed 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 123.643 2.928 . . . . 0.0 113.639 -160.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -81.09 157.85 25.24 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.469 -0.769 . . . . 0.0 109.073 167.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -78.58 139.05 38.64 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.9 ttt -154.17 133.96 12.98 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 442' ' ' PHE . . . . . 0.404 ' CZ ' ' CD1' ' A' ' 558' ' ' PHE 0.356 53.5 m-85 56.69 22.6 6.98 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 -176.509 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.81 11.03 66.19 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.741 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -146.38 146.4 30.62 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 117.775 0.788 . . . . 0.0 111.002 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -77.61 149.95 34.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.996 0.518 . . . . 0.0 111.361 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.1 ptt? -131.48 83.67 2.12 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.494 0.717 . . . . 0.0 109.281 176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.56 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 28.9 t-20 -54.66 129.26 35.96 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.163 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.606 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.461 2.1 t -123.79 150.61 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 113.118 -3.433 . . . . 0.0 115.953 168.417 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 33.8 t -160.82 172.01 17.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.538 1.135 . . . . 0.0 108.211 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -73.23 147.19 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.6 t -86.78 155.68 20.22 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.226 0.61 . . . . 0.0 111.491 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -92.88 -7.53 45.96 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -77.58 145.7 71.91 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.049 0.94 . . . . 0.0 110.34 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.7 -33.87 2.11 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.019 2.48 . . . . 0.0 111.388 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.91 161.66 10.89 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.458 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 64.5 mt -83.61 129.03 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 mmm -91.93 122.41 65.29 Favored Pre-proline 0 N--CA 1.454 -0.257 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 174.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.81 144.02 47.35 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.665 2.243 . . . . 0.0 108.827 174.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 169.69 -134.56 3.22 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.582 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -72.55 160.9 31.52 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.371 0.669 . . . . 0.0 111.369 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.3 p -145.03 171.94 13.77 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.461 1.104 . . . . 0.0 109.546 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -133.65 -0.49 3.18 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.35 179.78 51.14 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 112.172 -0.371 . . . . 0.0 112.172 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 81.9 mt -143.37 154.19 43.48 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.864 0.866 . . . . 0.0 109.25 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -75.26 -4.08 36.97 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.447 0.299 . . . . 0.0 110.98 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -120.43 11.11 11.34 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.223 1.009 . . . . 0.0 113.698 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -163.74 -144.84 4.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.056 -1.218 . . . . 0.0 110.056 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 97.6 p -133.0 -24.52 1.89 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.269 0.534 . . . . 0.0 112.138 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.2 t -127.06 149.73 49.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.754 0.421 . . . . 0.0 110.286 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.2 p -91.7 9.89 30.57 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.28 0.632 . . . . 0.0 110.856 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -143.92 150.9 39.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -155.22 157.68 37.7 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.606 0.241 . . . . 0.0 110.363 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -133.31 133.69 42.88 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -176.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.64 1.43 9.46 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.7 p -72.86 -6.91 48.15 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.545 0.738 . . . . 0.0 111.314 -179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -113.95 16.79 18.23 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.885 0.874 . . . . 0.0 111.528 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -139.03 150.92 46.35 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.87 6.48 41.69 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.909 0.884 . . . . 0.0 112.185 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -63.5 -25.72 68.39 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -67.32 150.37 49.1 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -69.9 -33.78 72.65 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.337 -0.545 . . . . 0.0 112.071 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.418 56.6 m-85 -98.08 10.19 41.04 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 177.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.4 t -69.24 -21.66 63.91 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -171.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 1.1 p -133.3 150.86 76.4 Favored Pre-proline 0 CA--C 1.529 0.145 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -175.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.8 Cg_endo -70.53 -23.5 27.22 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.168 2.579 . . . . 0.0 112.0 -177.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -73.76 -24.11 59.82 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.452 0.569 . . . . 0.0 110.217 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -83.21 -52.72 6.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 174.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.25 -20.39 64.19 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.762 0.825 . . . . 0.0 112.622 -171.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.51 60.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 117.943 0.338 . . . . 0.0 111.634 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -124.03 6.65 8.59 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.61 155.44 15.52 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.492 0.587 . . . . 0.0 112.233 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.405 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 13.4 ptp180 -152.98 147.23 25.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.0 mm -136.61 151.45 28.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 C-N-CA 123.379 0.671 . . . . 0.0 109.734 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -155.99 158.02 37.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -61.84 154.94 64.92 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -62.39 144.06 94.44 Favored 'Trans proline' 0 N--CA 1.449 -1.096 0 C-N-CA 122.811 2.341 . . . . 0.0 109.909 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.9 t -153.45 -179.99 8.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -83.73 0.01 48.98 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.989 -0.444 . . . . 0.0 110.802 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.0 t -100.18 137.24 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.3 mt -125.59 159.81 31.19 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 109.134 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -128.81 147.03 50.76 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -133.52 159.89 39.07 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -150.62 163.57 38.19 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 56.93 43.49 24.63 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.154 -0.341 . . . . 0.0 111.537 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.52 150.8 39.44 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.13 153.46 32.71 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.448 2.765 . . . . 0.0 112.673 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 507' ' ' LEU . 3.7 mm? -68.55 -16.52 63.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.079 0.552 . . . . 0.0 111.581 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -122.95 24.07 9.11 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.514 0.726 . . . . 0.0 110.98 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.8 p -64.29 -13.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.665 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.76 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -165.836 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -25.55 -37.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -169.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.1 mt-10 -58.37 -48.69 79.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 117.244 -1.36 . . . . 0.0 114.22 171.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -86.21 -27.16 24.67 Favored 'General case' 0 C--N 1.352 0.68 0 CA-C-N 122.407 2.367 . . . . 0.0 106.747 -173.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -64.57 -39.81 94.41 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -71.97 -42.45 66.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.35 -26.85 56.15 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.042 -1.063 . . . . 0.0 111.155 -177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.9 mt -70.55 -39.61 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 CA-C-N 118.825 0.739 . . . . 0.0 110.456 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.04 -34.16 77.45 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.012 -0.43 . . . . 0.0 110.786 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -70.77 -27.19 63.74 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -80.53 -8.55 59.62 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.354 0.261 . . . . 0.0 111.618 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.4 mt -114.91 -2.88 12.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.738 0.415 . . . . 0.0 111.578 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.28 0.35 56.96 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 119.78 -0.455 . . . . 0.0 112.271 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.0 148.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 CA-C-N 117.778 0.789 . . . . 0.0 110.851 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -69.55 145.5 52.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 120.89 0.376 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 -71.26 150.68 94.4 Favored Pre-proline 0 N--CA 1.455 -0.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.412 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.2 158.73 56.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.841 3.028 . . . . 0.0 111.095 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -90.9 -23.13 20.59 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.6 m -154.13 152.16 30.1 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.979 0.511 . . . . 0.0 111.119 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.04 156.56 19.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.76 0.824 . . . . 0.0 112.993 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -153.67 143.25 21.73 Favored 'General case' 0 C--O 1.228 -0.046 0 C-N-CA 122.918 0.487 . . . . 0.0 109.824 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.29 149.33 25.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.498 0.719 . . . . 0.0 112.207 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -156.45 -171.52 3.73 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.3 t -140.68 -176.65 4.73 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.872 0.869 . . . . 0.0 109.948 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.8 74.44 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.847 0.737 . . . . 0.0 111.967 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -96.36 -17.03 20.94 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 117.429 0.614 . . . . 0.0 111.279 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 48.3 t -164.05 151.55 12.27 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.3 0.64 . . . . 0.0 110.082 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.06 -7.77 31.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.667 0.387 . . . . 0.0 110.546 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -86.68 -33.72 19.97 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.603 0.761 . . . . 0.0 112.465 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 96.4 p -162.89 173.37 13.79 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.076 0.465 . . . . 0.0 111.48 -169.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.4 t -88.31 166.69 14.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.485 0.714 . . . . 0.0 110.934 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.1 p -149.69 162.86 39.39 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.382 1.073 . . . . 0.0 108.427 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.44 -172.79 45.67 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.572 -177.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -113.3 159.45 19.36 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.595 0.758 . . . . 0.0 110.321 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 15.0 tp -145.64 152.19 39.25 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.963 0.905 . . . . 0.0 108.726 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -150.44 148.65 29.01 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-N 119.197 0.908 . . . . 0.0 112.921 -174.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -123.47 175.73 6.6 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 125.245 1.418 . . . . 0.0 112.802 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.61 -5.38 57.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 40.7 t -158.31 155.73 29.35 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.195 0.598 . . . . 0.0 110.61 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -72.67 -24.21 60.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.521 0.328 . . . . 0.0 111.12 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.8 p -79.16 -24.12 43.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.931 0.332 . . . . 0.0 110.442 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -76.99 -31.6 56.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.424 0.29 . . . . 0.0 111.385 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.77 -28.04 58.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.34 -39.78 62.59 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.162 -0.336 . . . . 0.0 111.073 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -70.15 -36.77 74.97 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.483 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.3 m -69.79 -27.8 65.2 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.87 -38.26 90.17 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.82 -38.32 94.25 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' PHE . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 442' ' ' PHE 0.298 8.0 m-85 -92.44 -3.0 55.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 119.214 3.042 . . . . 0.0 119.214 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 37.4 mt -133.92 -6.71 2.75 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -69.76 143.22 53.07 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 120.46 1.482 . . . . 0.0 108.991 176.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 60.49 18.94 8.72 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.119 0.968 . . . . 0.0 113.271 178.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 34.5 t80 -70.13 135.3 49.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.51 139.32 47.53 Favored 'General case' 0 C--O 1.23 0.069 0 O-C-N 122.001 -0.437 . . . . 0.0 112.168 -174.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.52 152.45 24.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.296 175.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 10.5 ptmm? -83.65 46.26 1.14 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.839 0.856 . . . . 0.0 110.624 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -49.72 110.3 1.56 Allowed Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 123.663 0.785 . . . . 0.0 112.129 -173.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.67 -14.19 5.56 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.65 2.9 . . . . 0.0 111.474 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -90.59 6.05 45.33 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -173.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -162.2 167.76 36.94 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 118.502 0.592 . . . . 0.0 112.356 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -73.99 -10.37 22.89 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.841 3.694 . . . . 0.0 112.07 -178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -140.18 148.54 54.81 Favored Pre-proline 0 N--CA 1.455 -0.188 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.91 164.26 25.31 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 124.005 3.137 . . . . 0.0 111.792 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -129.88 142.33 50.68 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 102.006 -3.331 . . . . 0.0 102.006 171.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.274 0.6 OUTLIER -81.95 137.15 35.21 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -174.227 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -78.11 135.1 37.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' LYS . . . . . 0.463 ' HE2' " H1'" ' C' ' 2' ' ' ' C' . 0.1 OUTLIER -128.49 151.19 49.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -178.703 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.2 pp -151.38 166.48 30.91 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.489 0.662 . . . . 0.0 110.962 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 578' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 402' ' ' LEU . 45.2 t -159.81 163.0 34.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.781 0.832 . . . . 0.0 109.359 -174.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -57.52 124.74 20.04 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 172.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.45 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 34.0 t -75.1 149.03 39.22 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -170.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.271 0.6 OUTLIER -116.86 9.67 13.92 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 170.788 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.05 163.39 22.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.204 1.002 . . . . 0.0 111.816 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -92.5 -3.05 55.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.513 -178.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -155.14 174.61 14.96 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 123.572 0.749 . . . . 0.0 110.491 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.44 18.78 1.88 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.045 0.938 . . . . 0.0 109.855 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.221 -1.371 . . . . 0.0 110.918 -177.414 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.502 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.701 1 O4'-C1'-N19 112.437 4.237 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.792 0 C5'-C4'-C3' 110.573 -3.284 . 0.453 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.432 " O3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.949 1 C3'-C2'-C1' 105.521 4.468 OUTLIER-DELTA 0.199 4b . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . 0.481 ' C6 ' H5'' ' B' ' 4' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.928 1 C5'-C4'-C3' 108.525 -4.65 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . 0.431 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.754 1 O4'-C1'-N19 113.058 4.858 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.461 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 C3'-C2'-C1' 104.811 3.679 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.463 " H1'" ' HE2' ' A' ' 576' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.861 0 O4'-C1'-N19 111.055 2.855 . 0.084 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C3'-C2'-C1' 104.466 3.296 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.45 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 O4'-C1'-N19 111.259 3.059 . 0.246 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 1 C5'-C4'-C3' 108.715 -4.523 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.28 22.1 t80 . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.75 174.76 46.88 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 111.289 -0.724 . . . . 0.0 111.289 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.9 167.05 25.73 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.308 3.339 . . . . 0.0 111.101 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -156.66 159.69 38.65 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.746 0.418 . . . . 0.0 110.721 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.15 163.26 28.22 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.781 0.433 . . . . 0.0 111.209 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -71.53 -9.59 58.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.77 148.4 12.49 Favored Pre-proline 0 CA--C 1.53 0.21 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.162 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.13 -18.73 45.55 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.554 2.836 . . . . 0.0 112.085 172.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -87.6 153.32 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.5 tt -143.08 154.04 43.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.246 1.018 . . . . 0.0 108.907 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 382' ' ' MET . . . . . 0.481 ' HG3' ' C2 ' ' B' ' 2' ' ' ' C' . 77.3 mmm -132.01 141.73 49.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.62 0.368 . . . . 0.0 111.292 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.11 150.6 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.437 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 9.1 m-85 -141.36 173.45 11.48 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 -175.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.56 8.59 80.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.849 -0.5 . . . . 0.0 111.849 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 29.06 0.19 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.696 0.798 . . . . 0.0 112.248 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.14 -37.3 86.98 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 388' ' ' GLN . 8.3 pm0 -67.35 149.61 50.08 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 33.8 t -70.45 -9.75 57.32 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.301 0.64 . . . . 0.0 112.582 -175.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -71.4 -21.21 62.03 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 121.897 -0.502 . . . . 0.0 111.621 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 55.1 mmm -82.29 145.93 29.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.078 -0.389 . . . . 0.0 110.696 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -160.27 156.07 25.82 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.256 1.022 . . . . 0.0 108.452 177.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.8 p -59.99 -29.23 68.32 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -70.97 -42.44 69.72 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.201 0.455 . . . . 0.0 111.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -75.98 -42.7 47.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -175.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.5 t -69.45 -42.24 80.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.409 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 2.3 t80 -76.9 -32.88 57.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -169.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 0.418 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.5 p30 -74.17 -29.36 61.74 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 120.012 1.278 . . . . 0.0 109.897 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -59.67 -59.2 4.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.552 0.7 OUTLIER -76.65 -3.48 38.09 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 174.35 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 33.1 t -74.66 -37.77 62.63 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.873 -0.517 . . . . 0.0 111.323 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.37 -16.99 51.81 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -9.81 59.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 117.118 2.266 . . . . 0.0 117.118 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -174.03 -128.99 1.13 Allowed Glycine 0 CA--C 1.525 0.666 0 O-C-N 121.903 -0.498 . . . . 0.0 112.347 -175.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -138.08 127.0 23.98 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.563 0.745 . . . . 0.0 109.035 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.409 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.0 OUTLIER -114.07 165.57 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -175.176 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -122.35 -57.21 1.77 Allowed 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -154.52 162.55 41.09 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -142.8 152.54 17.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 124.474 1.11 . . . . 0.0 109.793 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -157.47 140.73 15.42 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -90.17 167.56 12.62 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 ptp -142.91 133.58 25.2 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 121.359 0.599 . . . . 0.0 111.7 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -5.66 54.62 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.648 1.179 . . . . 0.0 112.338 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 83.1 p -77.74 -1.23 30.24 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -140.24 156.37 69.98 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 124.452 1.101 . . . . 0.0 109.093 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -67.15 -12.57 36.49 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.181 2.587 . . . . 0.0 111.739 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.9 97.36 0.11 Allowed Glycine 0 C--N 1.337 0.621 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.33 159.82 37.88 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.963 0.505 . . . . 0.0 110.372 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -154.54 155.67 35.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.971 0.415 . . . . 0.0 111.048 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 43.7 ttm -108.98 148.76 30.24 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.479 1.112 . . . . 0.0 109.008 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.0 t -138.7 153.26 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 123.308 0.643 . . . . 0.0 111.431 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -140.8 132.52 27.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.332 0.515 . . . . 0.0 110.797 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 9.7 ptp -162.56 176.14 10.71 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.353 1.061 . . . . 0.0 110.535 -172.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.46 120.81 12.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 174.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -72.36 -33.47 67.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.42 -86.55 0.02 OUTLIER Glycine 0 CA--C 1.517 0.172 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.264 72.9 m-85 -74.78 -25.57 59.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -86.78 -37.19 18.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.905 -175.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.3 t -82.36 -32.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.339 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -69.22 -41.02 77.58 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -68.2 -38.61 82.15 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.52 0.6 . . . . 0.0 111.844 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -64.45 -35.29 80.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.277 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 51.5 mt -77.65 -15.89 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.184 0.594 . . . . 0.0 111.177 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 28.4 m -93.67 -19.47 21.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -133.67 -20.46 2.03 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 116.558 2.059 . . . . 0.0 116.558 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.36 -12.88 2.39 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 120.795 1.634 . . . . 0.0 114.648 -172.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.604 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.2 p-10 -71.47 100.96 2.32 Favored 'General case' 0 C--O 1.201 -1.471 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -168.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.9 m-80 78.63 22.05 0.72 Allowed 'General case' 0 N--CA 1.484 1.256 0 O-C-N 117.614 -3.179 . . . . 0.0 114.051 -161.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -74.16 162.8 28.59 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.428 -0.795 . . . . 0.0 109.706 167.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -80.22 142.45 34.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 172.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.6 ttt -158.64 134.28 8.81 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.352 45.6 m-85 58.39 11.04 1.5 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 97.44 3.71 58.5 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -128.96 -165.01 1.45 Allowed 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.184 0.994 . . . . 0.0 108.933 176.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -126.1 149.88 48.6 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 122.683 0.393 . . . . 0.0 111.31 -177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.2 ptm -124.62 75.57 1.42 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.231 1.012 . . . . 0.0 109.637 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -51.98 127.06 20.2 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 115.618 -2.134 . . . . 0.0 112.821 -174.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.604 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.439 2.1 t -126.29 152.17 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 113.21 -3.396 . . . . 0.0 115.952 169.161 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.46 167.27 17.73 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.028 1.331 . . . . 0.0 109.069 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.94 147.48 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 40.4 t -87.49 159.78 18.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.901 0.481 . . . . 0.0 111.865 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -100.5 -8.04 23.55 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.377 0.271 . . . . 0.0 110.6 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -76.79 150.54 81.67 Favored Pre-proline 0 N--CA 1.455 -0.202 0 C-N-CA 123.477 0.711 . . . . 0.0 111.104 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.99 -36.11 1.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.558 2.839 . . . . 0.0 112.178 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.37 157.68 9.24 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.198 0.599 . . . . 0.0 110.726 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.02 142.96 13.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 78.7 mtp -115.27 126.78 27.43 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 122.072 0.149 . . . . 0.0 111.346 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.88 168.28 23.76 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.79 2.994 . . . . 0.0 109.875 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.47 -135.3 4.77 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -72.33 157.35 37.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.17 0.588 . . . . 0.0 109.663 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 470' ' ' SER . 96.6 p -148.79 177.88 9.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.593 0.357 . . . . 0.0 110.72 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -122.17 4.47 9.79 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 81.98 -177.54 53.8 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 54.8 mt -144.65 168.14 20.89 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 124.057 0.943 . . . . 0.0 109.911 -178.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.3 pm0 -66.16 -31.1 71.74 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.203 0.601 . . . . 0.0 110.447 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -120.51 12.11 11.5 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -155.95 172.11 33.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 112.044 -0.423 . . . . 0.0 112.044 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.9 m -100.42 -18.39 16.74 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 10.6 p -127.13 154.31 44.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.306 0.643 . . . . 0.0 111.457 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' SER . . . . . 0.448 ' H ' ' HB2' ' A' ' 461' ' ' SER . 90.0 p -83.64 -3.55 57.83 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 122.777 0.431 . . . . 0.0 111.424 178.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.25 2.3 t80 -121.11 150.2 41.6 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -175.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -152.76 151.47 30.53 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.734 0.302 . . . . 0.0 111.131 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -119.36 138.04 53.33 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.07 5.01 4.14 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 115.969 1.841 . . . . 0.0 115.969 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 46.7 t -66.63 -28.48 68.51 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.746 0.418 . . . . 0.0 111.449 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -95.98 -6.66 38.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.892 0.477 . . . . 0.0 111.32 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.2 t -80.45 146.99 31.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.602 0.361 . . . . 0.0 111.201 -178.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -91.28 4.43 52.35 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.48 0.312 . . . . 0.0 111.106 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -63.93 -22.91 67.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.792 0.269 . . . . 0.0 111.017 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -60.81 134.16 56.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.501 0.72 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.7 tpt85 -80.96 -33.62 33.76 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -176.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.302 56.4 m-85 -97.99 11.95 35.84 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.685 2.476 . . . . 0.0 117.685 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 79.9 p -73.64 -10.35 59.61 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -172.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -136.47 147.81 61.42 Favored Pre-proline 0 N--CA 1.461 0.117 0 N-CA-C 115.405 1.631 . . . . 0.0 115.405 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.7 Cg_exo -64.77 -31.91 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.035 2.49 . . . . 0.0 112.392 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -79.15 -23.58 43.87 Favored 'General case' 0 CA--C 1.528 0.104 0 O-C-N 122.352 -0.218 . . . . 0.0 111.03 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -83.53 -41.34 18.06 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -61.33 -20.3 62.79 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.673 0.389 . . . . 0.0 111.874 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.75 -17.86 57.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -123.96 9.0 8.71 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -64.06 152.36 40.54 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.442 0.564 . . . . 0.0 111.998 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -143.85 125.97 15.49 Favored 'General case' 0 C--O 1.23 0.076 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.1 mm -143.38 -20.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.441 0.696 . . . . 0.0 110.838 -175.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 12.0 pm0 -65.4 160.67 21.44 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.513 0.725 . . . . 0.0 111.608 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 51.68 50.04 7.89 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 124.436 1.094 . . . . 0.0 113.893 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.67 146.6 84.54 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.634 2.223 . . . . 0.0 109.291 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 17.0 t -159.73 -157.91 0.61 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -175.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -83.74 0.6 46.52 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.319 0.648 . . . . 0.0 110.88 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 4.5 t -88.8 139.4 17.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 C-N-CA 123.337 0.655 . . . . 0.0 112.309 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.44 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 67.7 mt -122.19 156.63 33.31 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.458 0.703 . . . . 0.0 109.556 174.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -122.98 141.5 51.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -134.08 159.1 41.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.624 0.726 . . . . 0.0 110.706 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -151.51 163.37 39.16 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 103.093 -2.928 . . . . 0.0 103.093 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.48 57.33 4.42 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.551 0.341 . . . . 0.0 111.271 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -127.92 150.32 73.19 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.589 0.356 . . . . 0.0 111.1 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.37 153.36 34.66 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.7 2.933 . . . . 0.0 112.993 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 60.6 mt -68.54 -16.72 63.97 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.433 0.693 . . . . 0.0 112.506 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -122.81 23.84 9.28 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.838 0.855 . . . . 0.0 111.329 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.3 p -65.85 -12.01 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.709 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.35 -176.86 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -166.112 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.709 ' H ' HG22 ' A' ' 510' ' ' THR . 22.6 pt-20 -23.39 -41.49 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.0 -48.55 78.19 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 117.107 -1.425 . . . . 0.0 114.082 172.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -87.78 -27.59 22.22 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 122.481 2.4 . . . . 0.0 106.919 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -63.28 -37.74 88.43 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.308 -0.957 . . . . 0.0 113.521 175.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -73.47 -43.34 60.41 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.35 -21.17 56.47 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 119.99 -0.684 . . . . 0.0 111.823 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.7 mt -74.93 -37.6 41.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 174.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.5 m -66.22 -37.07 84.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.052 -0.405 . . . . 0.0 110.618 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -70.61 -26.86 63.69 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -74.98 -26.31 59.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.494 0.318 . . . . 0.0 110.831 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 82.2 mt -98.47 -5.26 32.72 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.05 0.54 . . . . 0.0 111.509 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.83 -1.37 54.25 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.406 0.527 . . . . 0.0 112.861 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.9 m -77.87 159.48 4.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 117.734 0.767 . . . . 0.0 112.527 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -69.38 146.14 52.34 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 123.014 0.526 . . . . 0.0 111.221 -178.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -74.73 154.43 87.25 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.727 0.811 . . . . 0.0 111.44 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.76 157.19 61.24 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.382 2.722 . . . . 0.0 110.33 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -90.16 -17.15 28.13 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.1 t -158.88 155.21 27.33 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.653 0.381 . . . . 0.0 110.624 177.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.7 m -142.84 153.83 17.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 C-N-CA 123.637 0.775 . . . . 0.0 113.039 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -150.19 142.29 24.03 Favored 'General case' 0 N--CA 1.458 -0.055 0 C-N-CA 123.479 0.712 . . . . 0.0 109.71 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.39 150.79 22.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -155.81 178.83 9.82 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 94.5 p -141.66 169.78 16.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.476 0.71 . . . . 0.0 110.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 116.91 -16.91 13.29 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 123.937 0.78 . . . . 0.0 111.959 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -84.71 -24.61 28.83 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 117.522 0.661 . . . . 0.0 112.285 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.6 t -163.13 155.41 18.29 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.937 0.495 . . . . 0.0 110.153 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.79 -7.64 33.18 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.598 0.359 . . . . 0.0 110.722 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.13 -31.67 44.21 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 95.8 p -165.47 170.44 14.43 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.051 0.453 . . . . 0.0 111.724 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 47.5 t -86.26 163.82 17.52 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.6 0.76 . . . . 0.0 110.16 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 68.4 m -141.99 161.38 38.12 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.978 0.911 . . . . 0.0 108.68 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.44 43.56 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 119.888 -1.149 . . . . 0.0 113.309 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -118.77 158.35 25.75 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.782 0.833 . . . . 0.0 110.229 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 84.3 mt -141.1 157.92 44.64 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 124.594 1.157 . . . . 0.0 108.645 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -147.62 150.27 34.1 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.359 0.527 . . . . 0.0 111.567 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' TRP . . . . . 0.44 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 15.7 m-90 -126.48 164.23 21.62 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.514 1.126 . . . . 0.0 112.202 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.01 -11.05 60.6 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.0 t -156.01 162.04 40.38 Favored 'General case' 0 C--N 1.339 0.138 0 O-C-N 121.536 -0.728 . . . . 0.0 111.57 -178.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -65.55 -31.82 73.07 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 122.887 0.475 . . . . 0.0 110.333 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 79.1 p -76.42 -28.46 56.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.215 0.206 . . . . 0.0 110.728 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -73.6 -34.44 65.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.62 -30.62 61.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 175.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 49.7 tp -74.92 -38.82 61.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 122.331 0.252 . . . . 0.0 111.334 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -74.1 -40.08 62.95 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.844 -0.535 . . . . 0.0 110.044 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.8 -24.67 62.61 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -68.23 -34.87 77.03 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 171.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -68.97 -32.43 73.34 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.491 -0.616 . . . . 0.0 112.302 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.287 8.2 m-85 -95.59 -9.7 31.53 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.92 -11.19 11.54 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-N 119.082 0.856 . . . . 0.0 113.254 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -74.38 138.68 43.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 119.153 0.888 . . . . 0.0 109.331 178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 60.36 22.51 12.03 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.581 0.752 . . . . 0.0 112.484 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 29.1 t80 -81.54 145.77 30.5 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -73.8 144.58 45.51 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.78 -0.575 . . . . 0.0 111.869 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 65.5 mtm -83.54 152.54 24.84 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -90.36 124.94 35.34 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 172.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -155.75 77.55 4.63 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 123.404 0.682 . . . . 0.0 109.331 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.08 -16.74 53.35 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.22 2.613 . . . . 0.0 112.203 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -88.16 -12.79 42.92 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.557 0.343 . . . . 0.0 111.594 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -93.5 161.12 24.9 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.0 -28.51 11.01 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.796 2.997 . . . . 0.0 111.341 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -158.34 151.98 19.33 Favored Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.87 162.08 43.02 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.466 2.777 . . . . 0.0 111.031 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.93 142.34 50.66 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.47 131.18 44.34 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -174.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.75 147.99 24.94 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.277 1.031 . . . . 0.0 109.347 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -140.8 154.11 46.1 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.793 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -158.59 161.37 37.24 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 27.0 p -158.36 174.82 14.55 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.495 0.718 . . . . 0.0 110.254 -176.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -59.73 124.26 19.56 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.423 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 30.2 t -85.67 150.35 24.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -171.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -110.38 9.25 23.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.66 163.37 16.51 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.609 0.764 . . . . 0.0 111.827 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 -89.58 -3.08 58.46 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.98 178.02 4.11 Favored 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 123.415 0.686 . . . . 0.0 110.142 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -136.72 18.83 3.06 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.74 0.416 . . . . 0.0 111.568 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.501 -1.238 . . . . 0.0 110.526 179.946 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.437 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 O4'-C1'-N19 112.125 3.925 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.481 ' C2 ' ' HG3' ' A' ' 382' ' ' MET . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 O4'-C1'-N19 111.452 3.252 . 0.432 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 1 C3'-C2'-C1' 105.141 4.045 . 0.225 0b . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.716 1 C5'-C4'-C3' 109.11 -4.26 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 1 O4'-C1'-N19 113.844 5.644 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.526 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.785 0 C5'-C4'-C3' 109.919 -3.721 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.72 0 O4'-C1'-N19 112.12 3.92 . 0.051 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.925 0 C3'-C2'-C1' 104.531 3.368 . 0.055 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.423 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 O4'-C1'-N19 111.205 3.005 . 0.233 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.535 1 C5'-C4'-C3' 108.588 -4.608 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.284 7.8 p90 . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 178.11 -172.67 45.22 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.33 161.13 12.02 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.206 3.271 . . . . 0.0 112.184 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -155.38 160.33 40.61 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 110.893 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.98 161.41 31.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.828 0.451 . . . . 0.0 111.134 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -70.6 -5.08 26.61 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.55 145.68 10.97 Favored Pre-proline 0 N--CA 1.456 -0.127 0 O-C-N 122.183 -0.323 . . . . 0.0 111.446 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.78 -18.69 62.03 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.672 2.915 . . . . 0.0 111.626 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 5.3 t -94.57 153.68 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 C-N-CA 123.607 0.763 . . . . 0.0 112.194 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -141.09 153.52 45.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.271 1.028 . . . . 0.0 108.789 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 74.1 mmm -130.39 133.73 46.6 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 122.91 0.484 . . . . 0.0 111.695 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.75 151.78 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.422 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.2 m-85 -144.22 177.99 8.22 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 105.38 -2.082 . . . . 0.0 105.38 -177.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 82.3 12.04 81.25 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 112.034 -0.427 . . . . 0.0 112.034 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 48.8 mt -78.24 26.26 0.21 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.514 0.657 . . . . 0.0 112.203 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -64.37 -37.89 89.1 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -176.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.451 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.6 pm0 -67.07 150.42 49.22 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.182 0.515 . . . . 0.0 111.055 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -70.04 -8.71 51.52 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.666 0.786 . . . . 0.0 112.974 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -76.85 -13.88 59.95 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.73 0.412 . . . . 0.0 111.676 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 56.4 mmm -85.07 152.15 23.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.963 0.411 . . . . 0.0 111.099 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.73 155.37 23.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 175.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 393' ' ' CYS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 411' ' ' PHE . 24.2 p -57.42 -32.0 66.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -175.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.06 -47.97 63.96 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 175.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.9 mtt85 -70.55 -39.11 74.17 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 116.821 -0.172 . . . . 0.0 110.972 -171.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.74 -46.35 74.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -77.68 -28.65 51.17 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.712 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -77.31 -29.11 53.51 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.392 0.997 . . . . 0.0 110.097 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 399' ' ' VAL . . . . . 0.576 HG22 HD12 ' A' ' 556' ' ' LEU . 2.7 t -59.93 -56.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.555 2.3 p90 -76.66 -3.21 36.65 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 173.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.503 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.4 t -73.01 -36.87 67.08 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.866 -0.521 . . . . 0.0 110.559 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.15 -11.67 22.11 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.779 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -89.22 -3.79 58.44 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.95 -169.82 41.05 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 118.795 0.725 . . . . 0.0 112.91 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -78.46 114.28 17.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 401' ' ' CYS . 2.5 m -114.09 165.49 9.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -127.87 -59.49 1.19 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -154.42 167.81 28.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -172.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.1 150.42 15.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 124.827 1.251 . . . . 0.0 109.84 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -151.54 128.78 11.21 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 123.353 0.661 . . . . 0.0 110.805 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 411' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 393' ' ' CYS . 3.3 m-85 -82.84 156.95 23.35 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 117.396 2.369 . . . . 0.0 117.396 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.17 127.77 37.77 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.712 0.405 . . . . 0.0 110.846 175.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.636 ' HE2' " H5'" ' B' ' 4' ' ' ' C' . 0.0 OUTLIER -79.21 -29.14 42.66 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.849 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 52.2 p -102.02 -19.51 15.17 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -80.5 154.27 73.9 Favored Pre-proline 0 CA--C 1.528 0.129 0 CA-C-N 118.456 0.571 . . . . 0.0 110.047 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.84 -15.87 48.39 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.085 2.523 . . . . 0.0 111.136 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 166.66 98.19 0.12 Allowed Glycine 0 C--N 1.336 0.538 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 176.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.17 37.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.334 0.654 . . . . 0.0 110.209 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.75 148.85 19.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 62.8 mtp -85.03 150.77 24.64 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.348 1.059 . . . . 0.0 109.037 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.89 146.39 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 C-N-CA 123.48 0.712 . . . . 0.0 110.414 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.44 ' C ' ' HG3' ' A' ' 423' ' ' MET . 71.4 tt0 -129.42 129.81 45.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.374 0.534 . . . . 0.0 109.888 176.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 423' ' ' MET . . . . . 0.546 ' HE2' ' HB1' ' A' ' 428' ' ' ALA . 49.9 mtp -150.77 167.68 26.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.335 1.054 . . . . 0.0 109.389 -169.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.76 122.38 17.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 170.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -72.34 -33.21 67.12 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -167.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.45 -89.57 0.01 OUTLIER Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.56 -25.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.546 ' HB1' ' HE2' ' A' ' 423' ' ' MET . . . -89.52 -35.15 16.1 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.99 -174.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 81.6 t -85.94 -26.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.345 0.401 0 C-N-CA 118.217 -1.393 . . . . 0.0 109.025 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -68.42 -50.06 55.51 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -66.91 -33.18 75.02 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 120.266 -0.574 . . . . 0.0 112.262 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.23 -36.72 82.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.841 0.746 . . . . 0.0 110.2 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.1 mt -79.21 -8.1 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.55 0.74 . . . . 0.0 111.184 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.7 m -100.08 -21.26 15.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -124.53 -27.77 3.68 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 -169.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.7 mt -134.52 -10.63 2.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.483 1.492 . . . . 0.0 114.711 -173.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.647 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -71.86 100.77 2.48 Favored 'General case' 0 C--O 1.204 -1.335 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -169.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.4 m-80 76.73 22.16 1.17 Allowed 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 123.381 2.81 . . . . 0.0 112.811 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.52 161.3 18.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 168.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.271 37.6 m-85 -74.47 138.4 43.2 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.0 ttt -157.11 142.53 17.37 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.386 0.674 . . . . 0.0 109.603 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 59.34 17.55 5.95 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.42 85.31 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -173.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -133.32 -159.35 0.96 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.773 1.629 . . . . 0.0 108.598 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -128.62 151.02 49.96 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.551 0.341 . . . . 0.0 110.779 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -129.25 82.58 2.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -58.69 127.4 31.99 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 115.98 -1.962 . . . . 0.0 113.343 -172.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.647 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.409 2.1 t -129.94 150.93 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 113.593 -3.243 . . . . 0.0 115.953 168.699 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.3 t -161.49 167.7 25.02 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.585 1.154 . . . . 0.0 109.27 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -72.31 150.86 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 41.6 t -90.71 166.56 13.07 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.334 0.653 . . . . 0.0 111.492 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -106.13 -6.42 18.61 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.621 0.368 . . . . 0.0 110.455 175.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -77.74 152.03 80.13 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 123.98 0.912 . . . . 0.0 111.613 -178.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.52 -38.89 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 123.14 2.56 . . . . 0.0 112.045 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.55 159.38 10.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.608 0.763 . . . . 0.0 110.479 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 64.9 mt -80.51 128.87 38.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 24.8 mmm -94.78 140.61 22.62 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.361 0.265 . . . . 0.0 111.292 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -73.38 158.18 48.59 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 123.318 2.679 . . . . 0.0 109.065 172.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 160.33 -133.95 3.45 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.694 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -72.31 167.8 19.69 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.441 0.696 . . . . 0.0 111.419 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.7 p -154.83 167.78 29.09 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.738 0.815 . . . . 0.0 109.785 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.78 -1.61 0.98 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.62 -171.14 54.41 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.5 mt -142.26 159.96 41.19 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.138 0.975 . . . . 0.0 109.229 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.55 -19.34 62.9 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -120.44 25.5 9.76 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -160.66 -159.15 9.71 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.7 t -133.0 -15.95 2.56 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 80.1 m -127.04 143.69 51.22 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.595 0.358 . . . . 0.0 111.441 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 71.9 p -93.84 3.47 55.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.348 0.659 . . . . 0.0 110.894 175.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -142.74 149.57 38.92 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.115 1.366 . . . . 0.0 114.254 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -154.61 152.88 30.53 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 117.994 0.361 . . . . 0.0 111.454 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -124.24 128.88 49.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.203 1.401 . . . . 0.0 112.45 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.282 3.3 m-85 -91.22 -6.64 53.07 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -177.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.7 t -75.09 -33.52 61.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -81.22 -17.07 50.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.575 0.35 . . . . 0.0 110.468 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 54.7 m -91.31 -3.81 56.47 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 60.91 -1.93 0.22 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.755 1.222 . . . . 0.0 113.204 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -64.73 -22.36 66.96 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.097 0.559 . . . . 0.0 112.064 -176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -59.42 115.6 3.38 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -81.02 -24.14 38.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.331 -0.395 . . . . 0.0 112.015 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.301 62.5 m-85 -97.94 17.44 18.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -64.1 -20.05 65.69 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.04 154.1 70.03 Favored Pre-proline 0 C--O 1.232 0.156 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 177.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -64.1 -23.49 67.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.087 2.525 . . . . 0.0 111.679 177.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -75.76 -29.46 58.82 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.331 -0.231 . . . . 0.0 110.675 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -82.0 -38.95 24.3 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.56 -19.67 65.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.667 0.387 . . . . 0.0 111.81 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.82 -16.73 54.91 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.0 0.37 8.52 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -65.33 157.25 29.66 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.289 178.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.71 118.28 10.96 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.93 41.85 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.437 0.695 . . . . 0.0 111.042 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -64.68 167.92 6.73 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.904 -0.498 . . . . 0.0 110.092 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -57.6 151.12 42.23 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 122.693 0.397 . . . . 0.0 110.777 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.12 162.27 36.42 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 123.479 2.786 . . . . 0.0 110.838 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 33.2 t -158.05 -176.86 6.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -83.68 -3.72 57.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -88.13 146.42 6.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 123.621 0.768 . . . . 0.0 112.572 175.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 8.8 tp -137.38 152.23 49.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.027 0.531 . . . . 0.0 109.833 -178.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -123.9 147.75 47.41 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.838 0.855 . . . . 0.0 109.131 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -142.29 161.53 37.79 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.689 0.757 . . . . 0.0 109.983 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -153.7 166.12 33.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 58.25 57.44 3.95 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.646 0.378 . . . . 0.0 111.434 -174.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -124.86 154.9 70.86 Favored Pre-proline 0 CA--C 1.533 0.299 0 C-N-CA 123.629 0.772 . . . . 0.0 109.935 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.41 156.74 64.91 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.202 1.935 . . . . 0.0 110.305 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.42 -16.53 63.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -173.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -115.36 25.14 11.06 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.5 0.72 . . . . 0.0 111.385 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.85 -14.24 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.96 -177.25 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -164.876 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.699 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.53 -39.4 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.1 mt-10 -59.27 -45.88 90.03 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 116.956 -1.497 . . . . 0.0 114.77 172.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -88.22 -27.18 21.95 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 122.852 2.569 . . . . 0.0 106.865 -174.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -65.77 -36.08 82.52 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.426 -0.909 . . . . 0.0 113.308 175.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -74.08 -44.26 54.68 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -76.59 -25.0 53.47 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.755 -0.778 . . . . 0.0 111.739 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.2 mt -72.22 -40.56 65.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 O-C-N 121.75 -0.594 . . . . 0.0 110.027 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 74.3 m -65.31 -30.24 71.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.23 0.468 . . . . 0.0 111.294 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -66.91 -39.44 87.4 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.915 0.388 . . . . 0.0 112.026 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -73.42 -6.75 48.29 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.04 -3.73 12.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.865 0.466 . . . . 0.0 111.778 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.88 -16.71 3.15 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.995 0.807 . . . . 0.0 113.931 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.5 m -77.39 156.8 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 118.461 1.13 . . . . 0.0 108.771 177.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -70.83 150.33 45.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.087 0.47 . . . . 0.0 111.496 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -76.19 157.41 83.1 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.311 0.644 . . . . 0.0 110.065 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.41 151.09 83.93 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 122.959 2.44 . . . . 0.0 110.549 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.0 t -83.53 -22.98 32.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -148.67 150.61 33.51 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.282 0.633 . . . . 0.0 110.665 178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.8 m -144.52 156.1 14.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 C-N-CA 123.655 0.782 . . . . 0.0 112.676 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -154.71 144.67 21.74 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.529 0.732 . . . . 0.0 109.505 175.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.96 152.48 28.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -155.51 -177.75 6.78 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.994 1.849 . . . . 0.0 115.994 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.1 p -143.49 -170.34 3.27 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.211 1.004 . . . . 0.0 109.846 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.56 -9.22 62.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.758 0.694 . . . . 0.0 112.254 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -94.43 -26.91 16.3 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 117.54 0.67 . . . . 0.0 111.648 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.4 t -164.59 156.94 16.44 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.235 0.614 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.99 -8.03 31.54 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.842 0.457 . . . . 0.0 110.787 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.26 -33.64 37.7 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 28.0 t -164.94 157.43 16.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.63 0.252 . . . . 0.0 111.651 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 95.3 p -82.9 176.24 9.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.454 0.702 . . . . 0.0 111.051 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.0 t -149.05 162.71 39.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.095 0.958 . . . . 0.0 108.445 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.31 -174.45 47.0 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.124 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.52 160.18 23.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.598 0.759 . . . . 0.0 110.394 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.5 mt -139.77 161.33 37.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.113 1.365 . . . . 0.0 108.347 178.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -151.38 148.39 28.07 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.248 -0.282 . . . . 0.0 111.573 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 22.2 m-90 -129.07 173.67 10.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.877 1.271 . . . . 0.0 111.915 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -7.99 54.74 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 46.8 t -162.03 165.06 27.83 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.193 -0.317 . . . . 0.0 111.295 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.92 -37.62 86.54 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 122.968 0.507 . . . . 0.0 110.269 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.2 p -72.26 -27.26 62.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -71.8 -39.75 69.67 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 175.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.6 -27.14 60.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 62.4 tp -77.89 -40.35 40.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -178.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -70.96 -36.76 72.69 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.65 -23.78 59.91 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 556' ' ' LEU . . . . . 0.576 HD12 HG22 ' A' ' 399' ' ' VAL . 0.9 OUTLIER -67.85 -44.57 76.83 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.113 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -61.55 -37.16 93.72 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-O 119.668 -0.518 . . . . 0.0 112.113 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.292 25.2 m-85 -84.95 -13.33 51.05 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.9 mt -110.81 -10.15 14.45 Favored 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -72.62 144.19 47.91 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.274 0.943 . . . . 0.0 108.829 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 58.77 18.96 6.44 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.952 0.901 . . . . 0.0 112.852 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.45 131.78 51.29 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -77.38 124.83 28.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 121.866 -0.522 . . . . 0.0 110.747 -177.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.0 mtm -83.54 152.57 24.82 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.287 0.235 . . . . 0.0 111.406 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -74.19 145.83 43.88 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -156.42 79.0 4.01 Favored Pre-proline 0 N--CA 1.455 -0.21 0 O-C-N 122.435 -0.166 . . . . 0.0 110.684 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -72.15 -9.93 25.17 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 123.083 2.522 . . . . 0.0 111.027 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.52 5.7 50.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.565 0.746 . . . . 0.0 112.455 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -153.13 166.79 31.65 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-N 118.314 0.506 . . . . 0.0 112.196 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.88 -17.44 22.6 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 124.268 3.312 . . . . 0.0 112.393 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -150.14 150.83 30.56 Favored Pre-proline 0 C--O 1.231 0.124 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.99 167.41 27.12 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.889 3.059 . . . . 0.0 111.266 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -129.87 142.44 50.67 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 103.177 -2.897 . . . . 0.0 103.177 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.271 0.7 OUTLIER -81.63 141.14 33.95 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -178.018 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.8 tt -86.46 152.52 22.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.954 1.302 . . . . 0.0 109.455 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.0 pttp -140.44 153.53 46.32 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.159 0.436 . . . . 0.0 110.697 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.46 161.71 38.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.191 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.5 p -161.6 171.52 17.89 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.971 0.909 . . . . 0.0 110.908 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -55.67 125.33 20.67 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.412 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 31.2 t -81.65 150.16 28.19 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -171.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -113.72 9.3 17.71 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.91 163.15 20.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.831 0.852 . . . . 0.0 111.542 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -89.41 -7.27 55.51 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.347 0.659 . . . . 0.0 111.776 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -172.49 172.21 4.41 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.668 0.787 . . . . 0.0 110.273 176.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -140.92 20.31 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.243 0.617 . . . . 0.0 111.793 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.2 t . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.691 -1.147 . . . . 0.0 110.499 179.878 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.422 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.728 0 O4'-C1'-N19 111.565 3.365 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.418 0 C5'-C4'-C3' 110.391 -3.406 . 0.386 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.511 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.895 0 O4'-C1'-N19 112.07 3.87 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . 0.636 " H5'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.818 1 C5'-C4'-C3' 108.261 -4.826 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 1 O4'-C1'-N19 113.43 5.23 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.563 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.865 0 C5'-C4'-C3' 109.741 -3.839 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C5'-C4'-C3' 110.978 -3.015 . 0.01 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C3'-C2'-C1' 104.509 3.343 . 0.063 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.412 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 O4'-C1'-N19 111.092 2.892 . 0.241 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.67 1 C5'-C4'-C3' 108.223 -4.851 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.291 7.3 p90 . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 75.08 -177.88 47.61 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.871 -0.491 . . . . 0.0 111.871 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -59.69 158.46 28.21 Favored 'Trans proline' 0 N--CA 1.454 -0.849 0 C-N-CA 124.515 3.477 . . . . 0.0 112.435 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -157.72 153.52 26.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.801 0.44 . . . . 0.0 110.701 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -77.8 157.78 29.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.468 0.307 . . . . 0.0 110.3 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 8.6 p30 -84.02 6.57 21.56 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 115.886 1.809 . . . . 0.0 115.886 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 29.8 t -153.72 143.98 15.62 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 119.387 -0.339 . . . . 0.0 111.105 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.5 Cg_exo -62.22 -3.03 3.56 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.387 3.391 . . . . 0.0 113.455 176.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.06 151.01 28.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -122.37 153.54 38.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.526 1.531 . . . . 0.0 108.291 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.7 tpt -135.13 128.41 32.08 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 117.773 0.26 . . . . 0.0 110.64 -176.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -122.4 153.23 26.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -175.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.517 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 3.2 m-85 -142.98 175.91 9.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.365 -2.458 . . . . 0.0 104.365 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.64 15.91 67.17 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 37.7 mt -86.46 19.6 2.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.389 0.675 . . . . 0.0 111.557 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.321 8.4 p30 -73.48 32.29 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 117.285 2.328 . . . . 0.0 117.285 -173.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -140.55 154.54 46.57 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 110.29 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 86.8 p -66.05 -11.45 48.44 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -78.63 -9.49 59.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.203 0.456 . . . . 0.0 111.635 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 60.1 mmm -97.32 149.75 21.74 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 117.936 0.334 . . . . 0.0 110.224 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -161.55 154.86 21.2 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 22.3 p -59.18 -35.8 74.19 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.16 -38.71 78.89 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -74.4 -51.33 15.3 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.98 -33.9 63.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.211 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.427 ' HA ' ' CE1' ' A' ' 400' ' ' PHE . 5.5 t80 -75.66 -30.64 59.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.584 -174.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -74.83 -32.46 61.95 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.443 1.019 . . . . 0.0 110.068 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 399' ' ' VAL . . . . . 0.431 HG22 ' CD2' ' A' ' 556' ' ' LEU . 30.0 t -57.52 -57.7 9.13 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 400' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 397' ' ' PHE 0.49 2.6 p90 -76.54 -5.08 46.08 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 117.646 2.462 . . . . 0.0 117.646 174.556 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.456 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.5 t -74.32 -34.54 63.48 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 118.198 0.453 . . . . 0.0 111.133 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 402' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' A' ' 403' ' ' TYR . 3.0 pp -61.41 -16.46 46.9 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.959 177.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 403' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 402' ' ' LEU 0.252 55.2 m-85 -85.08 -5.28 59.35 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 118.298 2.703 . . . . 0.0 118.298 -179.556 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.91 -167.07 39.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.475 -0.869 . . . . 0.0 113.303 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -84.95 120.06 26.07 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.683 0.793 . . . . 0.0 109.361 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.456 HG11 ' HA ' ' A' ' 401' ' ' CYS . 1.4 m -113.94 165.49 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.053 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -174.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -133.36 -57.36 0.9 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -149.79 164.28 35.72 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.44 147.01 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 124.625 1.17 . . . . 0.0 109.073 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.4 130.36 11.0 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.335 0.254 . . . . 0.0 111.64 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.3 m-85 -85.0 156.08 21.29 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.9 mmt -95.75 118.02 31.63 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.534 0.733 . . . . 0.0 112.244 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -79.11 -14.35 59.18 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.914 0.485 . . . . 0.0 111.124 172.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.7 p -90.26 1.47 56.47 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.625 0.77 . . . . 0.0 111.875 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 415' ' ' LYS . . . . . 0.435 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 46.8 mmtm -136.06 155.21 77.76 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 123.664 0.786 . . . . 0.0 110.46 -176.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.76 -15.67 33.37 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.249 2.633 . . . . 0.0 111.624 178.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.78 95.21 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.14 159.42 36.16 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.879 0.872 . . . . 0.0 109.281 177.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.56 156.64 21.1 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 71.8 mtm -102.58 154.73 18.84 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.427 0.691 . . . . 0.0 109.997 172.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.05 124.93 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 123.314 0.646 . . . . 0.0 110.893 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -103.62 127.84 51.0 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtm -154.63 172.4 17.92 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.796 0.838 . . . . 0.0 109.85 -174.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.79 122.07 16.04 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -72.35 -33.47 67.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.79 -87.97 0.01 OUTLIER Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -73.01 -26.81 61.46 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 117.185 2.291 . . . . 0.0 117.185 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.8 -37.19 19.52 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.052 -1.059 . . . . 0.0 111.798 -174.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.0 t -85.87 -26.22 6.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.622 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -66.42 -51.91 52.0 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.164 -0.335 . . . . 0.0 111.391 175.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -69.93 -31.15 68.77 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.38 72.66 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.915 0.78 . . . . 0.0 110.089 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -78.11 -15.48 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 123.222 0.609 . . . . 0.0 110.752 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.4 m -93.01 -18.88 22.15 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.458 ' C ' HD22 ' A' ' 436' ' ' LEU . 95.7 m-70 -129.77 -21.37 3.08 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -170.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.5 mm? -134.71 -12.34 2.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.956 1.707 . . . . 0.0 114.311 -174.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.6 p-10 -71.73 100.92 2.45 Favored 'General case' 0 C--O 1.205 -1.237 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -168.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.58 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 15.0 m-80 77.04 21.51 1.11 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 123.159 2.709 . . . . 0.0 113.771 -161.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -78.84 161.32 26.85 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.94 -1.1 . . . . 0.0 111.155 168.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' PHE . . . . . 0.418 ' CZ ' ' HE3' ' A' ' 445' ' ' LYS . 55.7 m-85 -71.3 142.42 50.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.2 ttt -162.5 134.52 5.42 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.392 50.8 m-85 55.98 27.32 11.06 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 83.72 8.78 84.02 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -132.5 178.33 6.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.315 1.046 . . . . 0.0 109.266 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' LYS . . . . . 0.418 ' HE3' ' CZ ' ' A' ' 440' ' ' PHE . 40.1 ttmt -125.19 133.75 52.64 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 111.033 178.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 63.0 mtm -80.63 -158.18 0.18 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.404 1.082 . . . . 0.0 109.046 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.58 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 37.1 t-20 -162.59 123.26 2.46 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 115.631 -2.128 . . . . 0.0 108.599 168.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.45 2.2 t -125.86 151.42 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 112.337 -3.745 . . . . 0.0 116.556 170.371 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 26.1 t -161.38 174.94 12.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.714 1.606 . . . . 0.0 107.938 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.2 p -73.95 149.36 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.3 t -84.21 158.45 21.29 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.882 0.473 . . . . 0.0 110.973 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.499 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 65.0 pttt -104.45 -1.81 26.21 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.459 -0.151 . . . . 0.0 110.692 176.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -86.79 146.47 41.18 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 123.176 0.59 . . . . 0.0 110.066 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.57 -31.14 4.49 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.319 2.68 . . . . 0.0 112.493 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.47 161.28 13.81 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.022 0.529 . . . . 0.0 110.382 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 79.0 mt -87.76 136.54 22.9 Favored 'Isoleucine or valine' 0 C--O 1.23 0.062 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 59.8 mmm -101.39 130.16 25.38 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.458 0.303 . . . . 0.0 110.913 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.54 171.42 18.07 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.608 2.872 . . . . 0.0 110.402 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 131.41 -125.41 4.4 Favored Glycine 0 C--N 1.336 0.551 0 N-CA-C 111.424 -0.67 . . . . 0.0 111.424 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -72.47 164.91 25.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.361 0.6 . . . . 0.0 112.21 -176.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 97.0 p -158.4 -179.16 7.84 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.154 0.981 . . . . 0.0 109.529 -177.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -140.88 161.96 36.58 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -80.65 131.69 10.67 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.4 mt -80.0 166.81 21.2 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.07 -22.57 64.0 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.248 -0.282 . . . . 0.0 111.178 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -120.52 25.83 9.54 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.154 0.582 . . . . 0.0 110.242 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.36 -163.07 14.33 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 121.859 -0.526 . . . . 0.0 112.419 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 48.4 t -133.09 -16.69 2.46 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.061 0.544 . . . . 0.0 111.551 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.5 t -127.09 145.98 50.54 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.957 0.503 . . . . 0.0 110.059 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 89.8 p -97.47 9.51 42.19 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.403 0.681 . . . . 0.0 111.628 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -136.15 147.24 47.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -157.84 154.15 27.55 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.606 0.362 . . . . 0.0 110.188 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 2.4 t0 -131.85 130.3 41.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -93.63 -8.89 39.8 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 117.252 2.315 . . . . 0.0 117.252 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 48.3 t -87.19 -32.27 19.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -79.25 3.8 16.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.568 0.747 . . . . 0.0 111.711 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 77.4 p -134.21 9.01 3.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.292 0.637 . . . . 0.0 111.767 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 62.77 -0.86 0.52 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.845 1.258 . . . . 0.0 113.986 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -59.21 -26.6 64.98 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.698 -0.626 . . . . 0.0 111.864 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -56.32 124.21 17.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.167 0.987 . . . . 0.0 109.994 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -81.02 -32.14 34.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -172.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.306 63.2 m-85 -97.92 17.1 18.99 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -69.12 -14.31 62.92 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -173.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.58 151.75 71.53 Favored Pre-proline 0 C--O 1.232 0.139 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 33.5 Cg_exo -65.0 -23.83 60.88 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 123.02 2.48 . . . . 0.0 111.426 176.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -75.71 -29.7 59.05 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.359 0.263 . . . . 0.0 110.452 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -82.4 -41.98 19.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 174.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.83 64.81 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -80.79 -19.04 45.66 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -4.5 7.96 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -63.67 157.14 24.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.276 0.489 . . . . 0.0 110.414 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -150.44 144.83 25.66 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.4 mm -137.65 148.05 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 123.331 0.652 . . . . 0.0 110.225 -171.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -150.51 169.04 22.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.108 0.963 . . . . 0.0 110.186 178.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -62.88 155.92 69.02 Favored Pre-proline 0 N--CA 1.455 -0.213 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -62.21 145.49 96.19 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 122.521 2.147 . . . . 0.0 109.561 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.2 t -153.98 173.99 15.25 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.978 0.511 . . . . 0.0 109.653 -174.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.71 -3.06 57.47 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.268 -0.27 . . . . 0.0 110.935 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -98.38 135.86 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.437 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 64.8 mt -125.41 152.14 45.25 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.372 0.669 . . . . 0.0 109.717 174.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -110.51 143.59 40.64 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 173.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -131.28 157.77 42.42 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.224 0.535 . . . . 0.0 111.647 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -152.19 167.68 27.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 103.847 -2.649 . . . . 0.0 103.847 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 54.39 31.87 15.39 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -93.57 156.21 39.93 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 117.685 0.22 . . . . 0.0 110.864 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.73 151.14 57.65 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 123.326 2.684 . . . . 0.0 111.754 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.46 -16.58 63.95 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.315 0.646 . . . . 0.0 112.412 -177.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -122.67 26.42 8.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.579 0.752 . . . . 0.0 111.005 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.57 -14.22 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.3 OUTLIER -54.74 -177.39 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -165.496 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.705 ' H ' HG22 ' A' ' 510' ' ' THR . 84.6 tt0 -10.33 -53.74 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.176 1.79 . . . . 0.0 114.919 -174.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.5 mt-10 -61.4 -41.18 96.72 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -89.35 -27.33 20.56 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 123.262 2.755 . . . . 0.0 106.398 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -61.71 -39.96 93.37 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.875 -1.13 . . . . 0.0 113.09 174.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -70.47 -45.95 64.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -77.88 -24.95 48.33 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 119.918 -0.713 . . . . 0.0 111.468 -177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 53.2 mt -70.53 -39.14 75.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 118.867 0.758 . . . . 0.0 109.417 176.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 85.6 m -65.66 -32.8 74.56 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.98 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -70.16 -27.18 64.33 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -80.02 -9.19 59.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.273 0.229 . . . . 0.0 111.577 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.26 -5.95 14.61 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.096 0.558 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.55 -10.06 13.48 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 123.715 0.674 . . . . 0.0 113.025 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.9 m -79.82 159.03 4.46 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.102 0 CA-C-N 118.131 0.966 . . . . 0.0 112.45 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -67.59 148.44 51.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 121.179 0.514 . . . . 0.0 111.376 -176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -81.6 158.07 68.97 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.602 0.761 . . . . 0.0 110.884 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.24 170.88 12.41 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 123.864 3.043 . . . . 0.0 110.43 172.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -119.21 -17.97 8.77 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 64.5 m -147.49 146.84 29.65 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 123.187 0.595 . . . . 0.0 109.884 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.24 156.94 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -175.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -150.34 141.05 22.66 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -138.53 142.17 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -154.06 -172.79 4.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 22.8 t -136.84 -174.29 3.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.625 0.77 . . . . 0.0 110.11 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.88 -15.53 62.53 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.04 0.828 . . . . 0.0 111.758 -178.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 50.4 mmtm -88.46 -28.32 20.93 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.453 0.627 . . . . 0.0 110.742 175.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.9 t -166.31 158.93 14.4 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.76 . . . . 0.0 109.963 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -117.05 -4.19 11.5 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.441 0.696 . . . . 0.0 109.855 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -24.26 21.55 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.654 0.782 . . . . 0.0 110.637 -179.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 13.0 m -158.71 167.17 30.22 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.763 0.825 . . . . 0.0 111.073 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 46.9 t -79.61 164.13 24.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.64 0.776 . . . . 0.0 111.569 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 39.6 t -151.95 150.42 30.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.479 1.111 . . . . 0.0 109.376 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 170.56 -173.6 44.43 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.815 -178.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -112.05 157.66 20.5 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 123.318 0.647 . . . . 0.0 110.17 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 28.2 tp -146.32 151.74 38.01 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -147.04 149.25 32.73 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' TRP . . . . . 0.437 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 17.7 m-90 -121.38 172.0 8.36 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.491 1.516 . . . . 0.0 112.536 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -74.99 -11.07 60.03 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.612 0.365 . . . . 0.0 111.137 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -156.72 158.96 37.86 Favored 'General case' 0 C--O 1.232 0.135 0 O-C-N 121.629 -0.669 . . . . 0.0 111.375 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.5 -26.25 62.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.537 0.335 . . . . 0.0 110.851 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.1 p -78.64 -25.53 45.01 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.75 -35.36 70.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 175.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.4 -28.55 59.48 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.755 -0.202 . . . . 0.0 110.665 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 39.6 tp -72.79 -44.02 62.06 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 117.875 0.307 . . . . 0.0 111.131 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -72.72 -39.48 66.89 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.904 -0.498 . . . . 0.0 109.947 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.47 -26.92 65.73 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' LEU . . . . . 0.431 ' CD2' HG22 ' A' ' 399' ' ' VAL . 5.7 tt -68.23 -32.39 72.56 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 172.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.39 -41.48 99.76 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.265 10.5 m-85 -89.05 -18.79 26.59 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.743 2.868 . . . . 0.0 118.743 178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.81 -16.68 15.33 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.754 0.706 . . . . 0.0 112.323 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -73.82 143.81 45.78 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 119.317 0.962 . . . . 0.0 108.846 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.85 18.45 2.99 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.516 1.126 . . . . 0.0 112.966 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.264 43.8 t80 -72.88 138.55 46.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -73.86 134.03 43.24 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.131 -0.356 . . . . 0.0 111.813 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.6 mtm -84.58 152.6 23.75 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 122.679 0.392 . . . . 0.0 111.663 176.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 168.77 17.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 170.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -150.04 149.28 27.02 Favored Pre-proline 0 CA--C 1.532 0.262 0 O-C-N 122.28 -0.263 . . . . 0.0 111.107 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.4 -29.59 9.18 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.304 2.669 . . . . 0.0 112.421 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -160.53 8.07 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -67.28 148.28 49.88 Favored Glycine 0 CA--C 1.532 1.123 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 -177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.94 -24.29 17.72 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.417 2.745 . . . . 0.0 111.368 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -153.55 149.82 22.06 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -74.59 163.51 35.79 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.663 2.909 . . . . 0.0 111.238 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -129.91 142.33 50.67 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 174.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.7 OUTLIER -81.94 138.7 34.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -177.559 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.8 tt -79.67 152.29 30.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.64 153.5 46.05 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.902 0.319 . . . . 0.0 110.665 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.33 166.33 33.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.784 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 43.1 t -155.92 160.03 39.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.91 0.884 . . . . 0.0 109.761 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -57.37 119.2 6.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.477 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 38.9 t -76.14 148.15 38.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.8 t -114.14 11.77 17.66 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 169.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.6 163.04 22.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.887 0.875 . . . . 0.0 111.942 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -93.53 -3.14 53.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.742 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -153.33 170.56 20.34 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.539 0.736 . . . . 0.0 110.752 -177.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.34 23.49 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.051 0.94 . . . . 0.0 109.873 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.369 -1.3 . . . . 0.0 110.61 -176.116 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.517 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.697 1 O4'-C1'-N19 112.335 4.135 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.499 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.75 0 C5'-C4'-C3' 110.428 -3.381 . 0.34 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.554 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.955 0 C3'-C2'-C1' 104.915 3.794 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.91 1 C5'-C4'-C3' 108.6 -4.6 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . 0.456 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.897 1 O4'-C1'-N19 112.755 4.555 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.503 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.821 0 C5'-C4'-C3' 109.711 -3.86 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.874 0 O4'-C1'-N19 111.269 3.069 . 0.098 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.927 0 C3'-C2'-C1' 105.022 3.914 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.477 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 O4'-C1'-N19 111.946 3.746 . 0.189 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 2 C5'-C4'-C3' 108.364 -4.758 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.255 8.0 p90 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -72.71 171.31 50.21 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.34 162.48 41.7 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.124 3.216 . . . . 0.0 111.08 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -156.01 156.51 34.56 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.796 0.439 . . . . 0.0 110.564 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.05 160.68 30.94 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.879 0.472 . . . . 0.0 111.034 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -73.78 -7.34 51.76 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 28.7 t -159.92 148.37 13.55 Favored Pre-proline 0 C--O 1.232 0.144 0 C-N-CA 122.924 0.489 . . . . 0.0 110.547 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.55 -16.01 46.19 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.26 2.64 . . . . 0.0 110.557 174.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -85.37 150.55 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.44 156.3 46.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.65 1.18 . . . . 0.0 108.563 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 45.6 tpp -137.48 135.72 37.08 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.208 -0.308 . . . . 0.0 111.082 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.17 152.0 34.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -176.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.487 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 13.4 m-85 -138.78 177.9 7.55 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 9.89 82.2 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.896 -0.391 . . . . 0.0 112.255 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 44.4 mt -78.27 28.03 0.19 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.473 0.709 . . . . 0.0 111.851 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -64.89 -27.55 68.93 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -175.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.49 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.5 pm0 -79.16 150.91 31.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.006 0.431 . . . . 0.0 111.208 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.7 m -70.72 -5.83 32.77 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.02 -15.32 61.52 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 118.093 0.406 . . . . 0.0 111.921 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 71.3 mmm -95.13 147.08 23.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.196 0.453 . . . . 0.0 111.382 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -158.73 163.52 36.72 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.357 1.063 . . . . 0.0 108.508 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 86.8 m -54.28 -44.62 72.04 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.061 0.391 . . . . 0.0 110.857 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -68.01 -37.28 81.24 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -74.08 -48.39 30.07 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.09 -39.62 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 6.9 t80 -75.91 -31.91 59.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -71.05 -38.45 72.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.159 0.436 . . . . 0.0 110.198 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -61.82 -48.32 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 120.102 -0.639 . . . . 0.0 112.608 -176.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.523 2.5 p90 -76.6 -12.07 59.96 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 168.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.3 t -66.86 -24.79 66.18 Favored 'General case' 0 C--N 1.338 0.071 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 402' ' ' LEU . . . . . 0.436 HD21 ' HB3' ' A' ' 578' ' ' CYS . 0.5 OUTLIER -49.52 -37.16 25.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.242 0.617 . . . . 0.0 110.926 173.065 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -79.51 -14.86 58.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -176.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.16 -174.6 45.99 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 118.939 0.791 . . . . 0.0 112.946 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -73.54 124.88 26.73 Favored 'General case' 0 C--O 1.231 0.109 0 O-C-N 122.644 -0.327 . . . . 0.0 111.754 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.443 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.4 m -114.09 165.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.096 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 178.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -126.42 -59.51 1.3 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -146.58 166.18 27.27 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 118.852 0.751 . . . . 0.0 112.98 -173.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.28 148.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 124.472 1.109 . . . . 0.0 109.332 175.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -157.3 126.19 5.81 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.116 0.566 . . . . 0.0 111.042 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.92 153.87 38.41 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 36.4 mmt -86.62 117.03 25.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.308 0.643 . . . . 0.0 110.317 175.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.411 ' HD3' " H5'" ' B' ' 4' ' ' ' C' . 11.5 ptmm? -79.21 -15.77 57.55 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.425 -0.172 . . . . 0.0 111.4 171.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 32.5 t -90.15 -5.88 55.98 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -124.34 154.81 69.1 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 123.351 0.66 . . . . 0.0 109.836 -176.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.26 -17.06 40.03 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.412 2.741 . . . . 0.0 111.86 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.08 94.75 0.09 OUTLIER Glycine 0 C--N 1.336 0.536 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.41 163.01 35.84 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.537 0.735 . . . . 0.0 109.462 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.39 143.04 13.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 84.7 mtp -82.59 151.68 26.27 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.8 t -146.53 153.79 12.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 422' ' ' GLU . . . . . 0.413 ' C ' ' HG3' ' A' ' 423' ' ' MET . 79.8 tt0 -135.22 133.42 39.0 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.102 -0.374 . . . . 0.0 110.002 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 423' ' ' MET . . . . . 0.413 ' HG3' ' C ' ' A' ' 422' ' ' GLU . 60.4 mtp -150.59 169.35 21.77 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.197 0.999 . . . . 0.0 109.461 -171.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.465 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.9 123.04 18.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 171.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.2 p30 -72.29 -33.55 67.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 -166.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.37 -89.62 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.33 -25.47 60.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.72 -32.68 16.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 118.735 -1.186 . . . . 0.0 112.208 -174.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.68 -24.31 6.09 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 C-N-CA 118.04 -1.464 . . . . 0.0 109.031 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -69.34 -47.78 63.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.785 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -63.7 -40.25 96.31 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.06 -36.72 85.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.464 0.574 . . . . 0.0 110.589 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.8 mt -81.73 -10.16 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 123.066 0.547 . . . . 0.0 111.706 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 52.8 m -102.26 -16.56 16.27 Favored 'General case' 0 N--CA 1.461 0.082 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -135.42 -19.74 1.65 Allowed 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -170.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 8.9 tp -134.57 -15.34 2.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -170.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 17.8 p-10 -71.38 101.0 2.28 Favored 'General case' 0 C--O 1.204 -1.31 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -169.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.7 m-80 78.2 21.98 0.82 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 123.988 3.085 . . . . 0.0 113.889 -161.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -76.05 159.76 30.48 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.331 -0.855 . . . . 0.0 110.713 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -78.12 138.78 38.9 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 174.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.8 ttt -159.23 135.81 9.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.793 0.437 . . . . 0.0 109.919 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.329 51.9 m-85 58.07 21.56 8.01 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.79 7.24 88.37 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -124.18 -167.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.365 1.466 . . . . 0.0 108.459 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -138.4 151.19 47.25 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.546 0.338 . . . . 0.0 110.534 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -130.42 87.66 2.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -56.26 129.47 40.42 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 115.541 -2.171 . . . . 0.0 111.594 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.447 1.9 t -125.88 149.45 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 113.531 -3.268 . . . . 0.0 116.353 168.947 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 42.0 t -159.54 165.97 31.81 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.778 1.231 . . . . 0.0 108.166 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -71.38 148.63 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 22.2 t -85.34 161.98 19.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.017 0.527 . . . . 0.0 110.851 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.472 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 65.1 pttt -106.74 -0.23 23.7 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 117.515 0.143 . . . . 0.0 110.914 177.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -82.01 151.55 67.15 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.53 0.732 . . . . 0.0 110.317 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -77.43 -35.88 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.257 2.638 . . . . 0.0 112.208 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.76 158.84 9.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.352 0.661 . . . . 0.0 110.583 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.4 mt -79.96 146.71 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 81.9 mtp -119.25 130.14 25.01 Favored Pre-proline 0 N--CA 1.454 -0.253 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.87 163.81 34.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.632 2.888 . . . . 0.0 110.122 176.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.03 -125.04 1.71 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -72.43 166.62 22.21 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.948 0.499 . . . . 0.0 111.239 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 34.3 t -157.81 165.73 34.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.615 0.766 . . . . 0.0 109.773 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -125.62 -1.61 7.39 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.79 -178.8 51.83 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.005 0.336 . . . . 0.0 112.488 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 90.5 mt -143.77 160.53 40.56 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.964 0.906 . . . . 0.0 109.769 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.51 -12.0 61.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.752 0.421 . . . . 0.0 111.647 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -120.48 20.74 11.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.175 0.59 . . . . 0.0 110.29 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -169.77 -153.37 8.52 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.2 m -132.92 -15.44 2.63 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.2 t -127.06 146.25 50.43 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.753 0.421 . . . . 0.0 110.117 176.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.7 p -93.82 10.5 32.88 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.415 0.686 . . . . 0.0 110.874 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -135.61 147.92 48.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -156.77 154.24 29.63 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-O 120.704 0.288 . . . . 0.0 110.375 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 0.4 OUTLIER -132.63 140.19 48.09 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.888 0.875 . . . . 0.0 113.148 179.46 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.291 15.8 m-85 -111.03 8.61 21.96 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 117.638 2.458 . . . . 0.0 117.638 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.2 t -71.67 -28.68 63.9 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -92.5 -18.66 22.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.919 0.888 . . . . 0.0 111.289 178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 75.0 m -76.59 -17.78 59.01 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.93 2.24 0.97 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.66 1.184 . . . . 0.0 114.103 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -62.74 -15.4 53.05 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.462 -0.774 . . . . 0.0 112.862 -178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.21 124.62 17.58 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.81 0.444 . . . . 0.0 110.976 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -72.81 -33.52 66.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.62 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.328 57.9 m-85 -98.02 17.27 18.75 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.2 t -61.76 -22.11 65.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.413 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -136.48 152.05 74.1 Favored Pre-proline 0 C--N 1.339 0.134 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -178.073 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 31.3 Cg_exo -63.68 -31.73 69.25 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.249 2.632 . . . . 0.0 112.43 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -78.86 -21.74 47.08 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 117.689 0.222 . . . . 0.0 111.091 -178.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -80.66 -41.95 22.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.84 -20.02 64.66 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.633 0.373 . . . . 0.0 111.912 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.42 -20.41 47.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.04 2.59 8.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -61.99 155.76 22.94 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.315 0.507 . . . . 0.0 111.934 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 18.4 mtt180 -141.92 131.57 24.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.5 mm -139.65 145.11 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 123.723 0.809 . . . . 0.0 109.001 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -158.29 159.22 35.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.152 0.581 . . . . 0.0 109.455 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -60.51 158.61 29.06 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -61.35 146.1 97.6 Favored 'Trans proline' 0 N--CA 1.451 -1.026 0 C-N-CA 122.292 1.995 . . . . 0.0 109.946 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -153.7 171.47 18.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -175.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -83.65 -7.88 59.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 1.9 t -85.46 141.92 13.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 174.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 11.7 tp -139.9 150.94 45.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.515 0.326 . . . . 0.0 110.209 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -125.01 150.06 47.1 Favored 'General case' 0 C--N 1.334 -0.106 0 C-N-CA 124.05 0.94 . . . . 0.0 108.848 -177.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -139.63 159.26 42.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.294 0.568 . . . . 0.0 111.952 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -150.42 166.34 30.39 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.3 m120 54.42 57.16 6.06 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.341 0.257 . . . . 0.0 111.215 -175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -129.34 150.61 76.02 Favored Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 122.455 0.302 . . . . 0.0 110.929 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.421 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 52.2 Cg_exo -55.96 156.51 19.5 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.703 2.936 . . . . 0.0 113.014 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.27 -16.68 64.05 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.461 0.704 . . . . 0.0 111.058 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -122.67 24.3 9.2 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.89 0.876 . . . . 0.0 110.831 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.0 p -63.3 -13.16 12.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -55.37 -177.6 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 117.977 -1.011 . . . . 0.0 113.556 -165.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.672 ' H ' HG22 ' A' ' 510' ' ' THR . 22.8 pt-20 -21.29 -41.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -170.138 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.3 mt-10 -56.1 -48.75 75.54 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 117.413 -1.28 . . . . 0.0 114.413 172.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -87.07 -26.07 23.87 Favored 'General case' 0 C--N 1.35 0.61 0 CA-C-N 122.474 2.397 . . . . 0.0 106.886 -173.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -66.98 -38.22 85.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -73.39 -40.27 64.46 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -76.07 -22.82 55.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.483 -177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 55.8 mt -77.08 -45.31 30.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-N 118.417 0.553 . . . . 0.0 110.924 178.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 28.4 p -71.81 -27.58 63.02 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.599 -178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -71.7 -36.77 70.65 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.792 0.33 . . . . 0.0 111.499 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.61 -28.77 66.22 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.388 0.275 . . . . 0.0 111.307 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 91.4 mt -94.85 -5.63 44.59 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.658 0.383 . . . . 0.0 111.569 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.86 1.61 62.84 Favored Glycine 0 CA--C 1.531 1.052 0 CA-C-O 119.584 -0.564 . . . . 0.0 113.119 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.3 m -76.91 163.65 3.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 118.18 0.99 . . . . 0.0 112.941 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.43 144.97 53.22 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -83.43 144.18 45.86 Favored Pre-proline 0 N--CA 1.455 -0.215 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.154 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -70.17 151.61 66.82 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.303 2.668 . . . . 0.0 110.839 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -95.51 -17.61 21.31 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 176.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 27.8 t -152.42 159.79 43.35 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-O 120.597 0.237 . . . . 0.0 111.031 175.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 7.5 p -155.27 150.1 11.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 C-N-CA 123.184 0.593 . . . . 0.0 110.267 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -150.53 144.06 25.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.465 1.106 . . . . 0.0 108.8 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.21 151.94 31.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -156.61 -173.27 4.4 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -178.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 90.8 p -140.42 -177.47 5.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.011 0.924 . . . . 0.0 110.376 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.26 -8.97 62.91 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 123.839 0.733 . . . . 0.0 112.223 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.32 -28.26 21.15 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.95 0.875 . . . . 0.0 111.437 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.5 t -166.4 159.71 14.92 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.26 0.624 . . . . 0.0 110.057 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.08 -7.83 31.79 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.631 0.372 . . . . 0.0 110.296 175.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -79.77 -30.52 40.73 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.8 p -164.91 168.7 17.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.196 0.522 . . . . 0.0 112.057 -173.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 40.6 t -82.82 166.93 18.57 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.756 0.823 . . . . 0.0 110.325 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 62.7 m -142.65 159.23 42.64 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.349 1.06 . . . . 0.0 108.405 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.47 -174.16 46.66 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 119.834 -1.175 . . . . 0.0 113.415 -179.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.24 160.27 22.5 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.691 0.796 . . . . 0.0 110.699 -177.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 87.6 mt -142.03 162.47 35.41 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.572 1.549 . . . . 0.0 108.198 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -152.32 148.69 27.82 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.26 -0.275 . . . . 0.0 110.907 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 10.5 m-90 -126.41 175.27 7.99 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 125.228 1.411 . . . . 0.0 112.624 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -75.59 -9.78 58.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 42.0 t -161.38 158.09 26.31 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 122.852 0.461 . . . . 0.0 110.635 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.0 -21.01 63.26 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.361 0.264 . . . . 0.0 111.13 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.3 p -80.69 -24.83 38.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 117.929 0.331 . . . . 0.0 110.65 177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -76.26 -34.16 59.16 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.16 -26.29 59.01 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 175.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.1 tp -77.41 -35.75 53.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.726 0.41 . . . . 0.0 110.882 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.97 -37.58 75.82 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.9 m -72.77 -30.21 63.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -63.48 -33.83 76.44 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.0 -56.58 17.67 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 14.3 m-85 -82.38 -16.89 47.48 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -175.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.74 -13.95 14.91 Favored 'General case' 0 C--N 1.338 0.08 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -73.68 142.3 46.41 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.894 1.225 . . . . 0.0 108.995 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 60.67 10.55 2.67 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.49 1.116 . . . . 0.0 112.967 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 33.6 t80 -73.48 141.47 46.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -73.02 142.48 47.69 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 564' ' ' MET . . . . . 0.421 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 78.4 mtm -83.58 152.33 24.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.316 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -76.47 -20.26 57.18 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.335 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 38.11 77.67 0.4 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.529 1.132 . . . . 0.0 112.91 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.58 -1.53 9.3 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.789 2.993 . . . . 0.0 112.684 -174.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 36.4 p30 -143.52 1.41 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -90.57 154.78 23.57 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.71 -23.16 19.72 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 123.387 2.725 . . . . 0.0 110.957 177.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.06 154.0 29.26 Favored Pre-proline 0 CA--C 1.529 0.164 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.76 154.51 67.64 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 123.126 2.551 . . . . 0.0 111.704 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -130.01 142.45 50.63 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 102.887 -3.005 . . . . 0.0 102.887 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 145.87 50.85 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 116.064 1.876 . . . . 0.0 116.064 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.4 tt -100.96 153.95 19.09 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.891 1.276 . . . . 0.0 108.378 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.8 155.42 44.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 120.982 0.42 . . . . 0.0 111.042 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.44 162.91 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.57 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 578' ' ' CYS . . . . . 0.436 ' HB3' HD21 ' A' ' 402' ' ' LEU . 17.0 p -159.24 164.86 34.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.473 0.709 . . . . 0.0 111.442 -172.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -56.53 123.51 15.06 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.1 t -77.43 145.65 37.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.268 0.8 OUTLIER -110.86 9.09 22.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 169.802 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.47 164.23 19.25 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.957 0.903 . . . . 0.0 111.112 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -90.75 1.31 56.99 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.939 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -177.41 176.58 1.29 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.531 1.132 . . . . 0.0 109.856 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -138.96 20.05 2.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.967 0.507 . . . . 0.0 111.226 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.248 -179.406 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.487 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 O4'-C1'-N19 112.117 3.917 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.472 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C5'-C4'-C3' 110.661 -3.226 . 0.393 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.537 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 O4'-C1'-N19 111.626 3.426 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . 0.411 " H5'" ' HD3' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.916 1 C5'-C4'-C3' 108.041 -4.973 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.763 1 O4'-C1'-N19 113.129 4.929 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.517 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.594 0 C5'-C4'-C3' 109.982 -3.679 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 O4'-C1'-N19 111.09 2.89 . 0.071 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.94 0 C3'-C2'-C1' 104.365 3.184 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.867 0 O4'-C1'-N19 111.09 2.89 . 0.217 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 1 C5'-C4'-C3' 108.113 -4.924 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.25 55.7 m-85 . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.61 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -68.32 168.92 18.1 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.111 3.208 . . . . 0.0 110.847 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -149.3 156.87 42.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.988 0.423 . . . . 0.0 110.74 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.58 162.39 29.27 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.901 0.48 . . . . 0.0 111.164 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -72.64 -8.0 53.13 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -178.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -159.64 148.53 14.02 Favored Pre-proline 0 N--CA 1.455 -0.221 0 C-N-CA 122.635 0.374 . . . . 0.0 110.948 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.57 -19.29 44.17 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.697 2.931 . . . . 0.0 111.56 172.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.79 148.56 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.0 tt -132.67 152.83 51.58 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.981 1.313 . . . . 0.0 108.372 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -135.96 132.44 36.39 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -175.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.38 153.6 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.503 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 2.5 m-85 -143.85 166.14 25.75 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 104.778 -2.304 . . . . 0.0 104.778 -178.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 91.62 11.3 60.82 Favored Glycine 0 CA--C 1.529 0.914 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 54.3 mt -81.19 35.11 0.38 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.934 0.894 . . . . 0.0 110.91 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.292 8.5 p30 -81.65 25.21 0.54 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -171.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -134.45 157.79 45.56 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 123.042 0.537 . . . . 0.0 110.684 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -69.08 -11.53 60.87 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.65 0.78 . . . . 0.0 112.962 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -80.31 -9.25 59.73 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.5 0.32 . . . . 0.0 111.563 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 61.6 mmm -96.23 144.26 26.59 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 118.021 0.373 . . . . 0.0 110.273 -177.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -159.51 153.22 22.86 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.5 p -58.54 -30.23 66.94 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -72.05 -41.84 66.99 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 177.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 84.6 mtt-85 -75.99 -44.97 37.06 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.731 0.301 . . . . 0.0 111.245 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.29 -41.73 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -174.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -73.63 -41.14 63.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 0.495 ' HA ' ' SG ' ' A' ' 401' ' ' CYS . 3.9 p30 -66.56 -31.13 71.64 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.696 -0.802 . . . . 0.0 109.269 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.84 -60.77 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 107.186 -1.412 . . . . 0.0 107.186 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.481 0.6 OUTLIER -76.61 -20.48 56.7 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 118.936 2.939 . . . . 0.0 118.936 177.765 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 398' ' ' ASN . 2.8 p -81.64 -19.26 42.13 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.07 0.85 . . . . 0.0 111.139 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 402' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 402' ' ' LEU . 3.5 pp -61.29 -15.2 32.88 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.978 0.808 . . . . 0.0 111.107 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -76.46 -8.12 56.51 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -171.14 -147.57 5.69 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 -175.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -88.22 159.88 17.95 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.712 0.405 . . . . 0.0 110.965 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.469 HG22 ' HB3' ' A' ' 480' ' ' ASN . 1.7 m -114.17 154.07 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -176.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -144.77 -74.66 0.24 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -149.05 167.58 25.48 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 -172.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 4.3 p -154.81 147.28 13.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 124.794 1.237 . . . . 0.0 108.551 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -157.04 133.37 9.81 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -81.39 168.32 18.49 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.942 1.83 . . . . 0.0 115.942 177.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 50.5 mtt -130.89 128.18 40.03 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-O 120.9 0.381 . . . . 0.0 111.6 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.4 ' HG3' ' H ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.2 -5.94 55.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.832 0.853 . . . . 0.0 112.341 175.145 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.5 p -83.32 -7.25 59.61 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.331 0.652 . . . . 0.0 112.451 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.08 157.55 77.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 C-N-CA 123.86 0.864 . . . . 0.0 109.422 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.93 -14.25 43.0 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.26 2.64 . . . . 0.0 111.235 177.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.74 98.67 0.11 Allowed Glycine 0 C--N 1.338 0.645 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 175.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.84 158.17 36.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.36 0.664 . . . . 0.0 109.492 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.39 150.85 23.9 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.275 0.559 . . . . 0.0 112.231 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 34.6 ttm -96.57 151.8 19.25 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.559 1.144 . . . . 0.0 108.313 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 37.9 t -144.85 154.28 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -142.42 135.8 28.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 71.7 mtm -160.45 177.58 10.42 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.355 1.462 . . . . 0.0 108.987 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.61 125.5 24.47 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 171.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -72.3 -33.57 67.5 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.34 -84.43 0.04 OUTLIER Glycine 0 C--N 1.333 0.413 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -73.52 -29.32 62.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.25 -35.14 18.67 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.431 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.43 -24.96 6.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.311 0 C-N-CA 118.916 -1.114 . . . . 0.0 109.828 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -70.33 -50.37 39.85 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.46 174.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -64.32 -36.05 82.86 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.623 -0.673 . . . . 0.0 112.032 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.63 -34.57 78.53 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.005 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -80.62 -8.04 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.528 0.731 . . . . 0.0 111.141 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 7.1 m -100.37 -18.87 16.56 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 176.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -131.89 -21.34 2.44 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -170.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 86.7 mt -134.43 -14.37 2.25 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.0 p-10 -71.65 100.86 2.39 Favored 'General case' 0 C--O 1.205 -1.285 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -170.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.525 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 22.7 m-80 77.07 21.94 1.06 Allowed 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 124.11 3.141 . . . . 0.0 112.526 -159.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -87.65 154.95 20.19 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 168.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -78.33 140.58 38.78 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -154.87 134.63 12.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.198 0.599 . . . . 0.0 110.272 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.388 48.4 m-85 59.43 19.09 7.44 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.93 10.73 62.46 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 120.017 -0.324 . . . . 0.0 112.446 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -146.14 150.18 35.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 117.411 0.606 . . . . 0.0 110.405 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -84.94 149.69 25.46 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.253 -0.279 . . . . 0.0 110.928 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -131.37 92.43 3.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.983 0.513 . . . . 0.0 109.636 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.525 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 21.5 t-20 -58.51 130.7 48.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 115.877 -2.011 . . . . 0.0 112.048 -171.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.451 2.2 t -124.88 149.7 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 113.46 -3.296 . . . . 0.0 116.416 168.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 34.4 t -161.39 172.91 15.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.162 1.385 . . . . 0.0 108.302 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.92 145.7 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 30.2 t -85.55 157.93 20.27 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 122.744 0.418 . . . . 0.0 110.877 177.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -96.57 -4.32 41.46 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.435 -0.166 . . . . 0.0 110.777 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -78.95 152.15 76.84 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.736 0.814 . . . . 0.0 111.111 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.13 -34.81 1.04 Allowed 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.56 2.84 . . . . 0.0 112.068 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.28 159.76 10.97 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 122.961 0.504 . . . . 0.0 111.107 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.3 mt -78.27 136.7 23.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 61.4 mmm -103.59 125.12 35.7 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 122.311 0.244 . . . . 0.0 110.975 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -78.16 173.31 14.1 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.904 3.07 . . . . 0.0 110.187 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 128.52 -108.57 0.92 Allowed Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -72.42 153.17 41.56 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.349 0.659 . . . . 0.0 110.679 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.2 p -159.04 175.22 13.8 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.28 0.632 . . . . 0.0 110.095 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -143.33 163.82 31.97 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.91 135.11 14.5 Favored Glycine 0 CA--C 1.525 0.659 0 O-C-N 122.099 -0.376 . . . . 0.0 112.66 -174.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.34 165.58 14.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.253 0.621 . . . . 0.0 109.516 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -72.7 -19.54 61.38 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.162 -0.336 . . . . 0.0 111.732 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -120.52 24.9 10.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.088 0.555 . . . . 0.0 109.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.2 -159.62 13.08 Favored Glycine 0 C--N 1.337 0.631 0 O-C-N 121.715 -0.616 . . . . 0.0 111.817 -177.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.5 t -133.09 -17.86 2.36 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.8 t -127.1 143.53 51.25 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.73 0.412 . . . . 0.0 110.04 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.6 p -86.74 1.59 51.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 123.168 0.587 . . . . 0.0 111.809 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.258 19.6 t80 -128.57 145.72 51.05 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 115.634 1.716 . . . . 0.0 115.634 -178.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -153.61 149.5 27.66 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.857 0.463 . . . . 0.0 109.952 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.251 0.1 OUTLIER -130.2 140.87 50.69 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 179.006 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 474' ' ' PHE . . . . . 0.408 ' HB3' HG21 ' A' ' 406' ' ' VAL 0.267 65.7 m-85 -111.75 -2.43 15.3 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -178.653 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 44.7 t -73.59 -26.31 60.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.13 14.99 2.06 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.699 0.8 . . . . 0.0 111.028 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 48.3 t -137.24 169.23 18.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.604 0.762 . . . . 0.0 110.56 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.04 6.49 31.2 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.111 0.565 . . . . 0.0 111.569 -176.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -62.06 -18.5 60.85 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' ASN . . . . . 0.469 ' HB3' HG22 ' A' ' 406' ' ' VAL . 0.4 OUTLIER -59.08 117.92 5.25 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.098 0.559 . . . . 0.0 111.657 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -81.17 -33.59 32.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.277 62.3 m-85 -97.94 3.5 49.6 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -176.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 57.8 m -87.76 7.0 32.32 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -172.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.448 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.77 144.46 53.0 Favored Pre-proline 0 C--O 1.231 0.1 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 177.278 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 485' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.0 Cg_exo -64.66 -29.58 60.36 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.024 2.482 . . . . 0.0 112.372 -178.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -81.33 -26.4 35.66 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.667 -0.206 . . . . 0.0 111.18 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -82.25 -42.35 19.01 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.29 0.496 . . . . 0.0 110.906 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.35 -16.45 54.52 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.97 -21.52 33.98 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -124.04 4.13 8.64 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -64.02 155.44 31.14 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.779 0.718 . . . . 0.0 111.493 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -144.06 126.21 15.56 Favored 'General case' 0 N--CA 1.458 -0.062 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -174.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.8 mm -148.63 123.25 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 C-N-CA 124.351 1.06 . . . . 0.0 108.324 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -162.1 97.68 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.901 0.318 . . . . 0.0 110.781 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' HIS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 496' ' ' PRO . 15.1 p80 54.32 155.13 0.05 OUTLIER Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 127.501 2.32 . . . . 0.0 114.596 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 496' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 495' ' ' HIS . 91.5 Cg_endo -75.7 76.2 3.75 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.536 2.824 . . . . 0.0 109.837 176.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.1 t -65.01 161.0 19.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.129 0.572 . . . . 0.0 110.856 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -83.84 -7.41 59.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 5.0 t -85.32 148.7 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.952 0.901 . . . . 0.0 110.8 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 10.2 tp -136.59 151.57 49.5 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -123.25 146.21 48.04 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -140.13 155.64 46.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.459 0.647 . . . . 0.0 109.34 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -148.44 163.77 36.15 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 104.423 -2.436 . . . . 0.0 104.423 -174.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 60.94 57.23 2.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.733 0.813 . . . . 0.0 112.044 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -137.39 137.09 21.42 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.945 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -49.83 159.91 1.42 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.863 3.042 . . . . 0.0 113.038 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 507' ' ' LEU . 2.9 mp -68.52 -16.5 63.9 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -173.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.6 19.93 11.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 15.2 m -71.55 5.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.67 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.8 OUTLIER -54.88 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 117.497 -1.24 . . . . 0.0 113.223 -167.69 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.67 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -23.64 -37.29 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -171.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 92.9 mt-10 -56.85 -49.74 74.56 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 117.416 -1.278 . . . . 0.0 114.009 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -85.1 -25.75 27.34 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 122.286 2.312 . . . . 0.0 106.69 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -65.87 -38.37 88.61 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -74.44 -42.12 59.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.47 -24.64 59.07 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.094 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -74.48 -38.68 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.27 0.486 . . . . 0.0 109.983 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 93.5 m -67.41 -36.61 81.61 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 122.023 -0.423 . . . . 0.0 110.863 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -69.62 -29.18 66.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -76.58 -27.36 55.81 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 122.15 0.18 . . . . 0.0 111.186 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 80.1 mt -96.07 -6.06 39.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.893 0.477 . . . . 0.0 111.62 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.47 -8.57 25.81 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-O 119.472 -0.627 . . . . 0.0 113.195 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 m -76.92 155.37 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 118.384 1.092 . . . . 0.0 112.022 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -68.54 151.12 47.22 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.297 0.57 . . . . 0.0 112.024 -173.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -71.94 155.04 92.4 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.984 0.913 . . . . 0.0 111.286 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.24 155.1 65.12 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.387 2.725 . . . . 0.0 110.949 175.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -88.38 -20.57 25.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 14.1 t -153.91 164.03 39.08 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 110.994 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 3.1 p -160.34 146.81 5.93 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 C-N-CA 123.119 0.568 . . . . 0.0 109.469 -176.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -143.23 137.8 29.2 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.166 0.986 . . . . 0.0 108.929 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.2 146.99 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.343 0.657 . . . . 0.0 110.834 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -155.38 174.84 14.66 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 -173.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 80.8 p -62.93 134.78 56.73 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.503 0.668 . . . . 0.0 110.347 177.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -70.84 163.96 53.49 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.502 -175.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -81.05 12.13 3.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.411 1.084 . . . . 0.0 111.5 177.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 30.2 t -155.38 -172.73 4.27 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.335 1.054 . . . . 0.0 108.968 -177.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.85 -7.88 32.36 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -89.55 110.4 21.25 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.428 0.691 . . . . 0.0 110.593 172.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 68.2 m 53.6 -163.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.882 0.873 . . . . 0.0 112.954 174.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 20.7 m -140.8 178.49 7.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.523 1.129 . . . . 0.0 110.896 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.8 m -137.6 168.56 19.42 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . -174.88 179.32 46.26 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.669 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -121.75 158.4 28.87 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.729 0.812 . . . . 0.0 109.864 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.1 mt -141.26 166.7 24.05 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 124.728 1.211 . . . . 0.0 109.385 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -153.85 150.74 28.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.193 -0.317 . . . . 0.0 110.708 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 20.8 m-90 -130.54 165.52 22.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.792 1.237 . . . . 0.0 111.638 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -68.17 -7.04 26.63 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.2 t -160.13 160.92 33.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.559 0.344 . . . . 0.0 110.794 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -67.46 -27.96 67.47 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 177.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.0 m -76.95 -26.58 54.18 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.462 0.305 . . . . 0.0 110.727 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.19 -36.89 66.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 177.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.95 -24.55 52.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 175.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.9 tp -78.79 -36.81 42.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.895 0.478 . . . . 0.0 111.481 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -75.22 -38.73 60.55 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.85 -24.41 64.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.33 -33.7 73.52 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.42 -27.03 73.26 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.34 9.1 m-85 -100.31 -6.11 26.39 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 118.961 2.949 . . . . 0.0 118.961 177.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.6 mt -123.9 -9.42 7.76 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -73.36 139.69 46.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.838 1.199 . . . . 0.0 109.356 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 56.19 17.44 2.76 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.311 1.045 . . . . 0.0 112.719 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -70.32 138.94 51.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -74.42 129.55 37.98 Favored 'General case' 0 N--CA 1.455 -0.185 0 O-C-N 122.195 -0.315 . . . . 0.0 111.083 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.9 mtm -83.53 152.45 24.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.569 0.223 . . . . 0.0 111.122 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -74.31 -16.74 60.92 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.933 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 40.91 80.47 0.28 Allowed Pre-proline 0 CA--C 1.533 0.311 0 C-N-CA 125.752 1.621 . . . . 0.0 112.476 177.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -73.56 9.09 1.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 124.018 3.145 . . . . 0.0 112.165 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -139.02 21.47 2.63 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -176.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -157.37 159.9 30.12 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 122.088 -0.382 . . . . 0.0 112.726 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.03 -16.45 20.14 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 124.715 3.61 . . . . 0.0 112.909 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.262 4.7 p90 -144.31 148.97 43.03 Favored Pre-proline 0 CA--C 1.528 0.104 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.4 157.06 57.51 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.588 2.859 . . . . 0.0 112.264 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.87 142.46 50.66 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 102.807 -3.035 . . . . 0.0 102.807 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -73.35 137.56 44.81 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -86.3 138.25 31.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.928 1.291 . . . . 0.0 108.145 175.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.99 146.57 50.62 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.597 0.635 . . . . 0.0 110.458 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.3 161.29 39.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.091 0.472 . . . . 0.0 111.281 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.53 172.14 14.85 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.039 0.935 . . . . 0.0 110.166 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -54.99 121.96 9.85 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.438 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 32.1 t -78.65 152.33 31.75 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.4 t -118.61 10.64 12.59 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 170.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.33 162.49 14.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.47 0.652 . . . . 0.0 111.867 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -82.99 8.88 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.894 0.878 . . . . 0.0 112.741 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -160.2 178.11 9.98 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.475 0.579 . . . . 0.0 111.31 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.51 12.43 1.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.085 0.954 . . . . 0.0 110.112 169.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.39 -1.29 . . . . 0.0 110.401 -176.391 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.503 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 O4'-C1'-N19 112.16 3.96 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.782 0 C5'-C4'-C3' 110.446 -3.37 . 0.4 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.561 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 O4'-C1'-N19 111.797 3.597 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 1 C5'-C4'-C3' 108.942 -4.372 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.936 1 O4'-C1'-N19 112.844 4.644 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.55 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 C5'-C4'-C3' 109.652 -3.898 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 O4'-C1'-N19 111.496 3.296 . 0.021 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.074 0 C3'-C2'-C1' 104.722 3.58 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.438 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O4'-C1'-N19 111.007 2.807 . 0.23 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 1 O4'-C1'-N19 112.897 4.697 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.282 17.5 t80 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -179.35 173.22 45.22 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.07 176.3 7.95 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.408 3.405 . . . . 0.0 110.84 177.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -147.3 153.37 39.65 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 122.836 0.455 . . . . 0.0 110.719 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -76.28 159.47 30.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.767 0.427 . . . . 0.0 110.714 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -82.44 1.48 37.3 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.4 t -157.77 145.38 13.72 Favored Pre-proline 0 N--CA 1.456 -0.174 0 C-N-CA 122.83 0.452 . . . . 0.0 110.69 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.54 -15.05 41.04 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.661 2.907 . . . . 0.0 110.676 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 t -88.93 149.0 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.57 155.88 47.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.253 1.021 . . . . 0.0 108.429 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.1 tpt -139.37 133.76 31.55 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 122.01 -0.431 . . . . 0.0 110.808 -174.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.16 153.53 37.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.519 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 6.9 m-85 -139.48 166.45 24.53 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 90.68 9.48 64.37 Favored Glycine 0 CA--C 1.529 0.954 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.659 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.8 mt -78.1 25.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.77 0.785 . . . . 0.0 112.483 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -67.49 -15.57 63.74 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -72.21 155.36 40.31 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.644 -0.66 . . . . 0.0 111.958 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.8 p -68.72 -9.17 48.98 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 123.591 0.756 . . . . 0.0 111.328 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -95.63 5.08 52.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.723 0.809 . . . . 0.0 111.254 -173.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 59.1 mmm -106.33 138.14 43.04 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -177.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -160.18 157.98 29.3 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.443 0.697 . . . . 0.0 109.863 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 92.9 m -52.27 -41.76 63.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.58 0.352 . . . . 0.0 111.668 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -72.17 -36.51 69.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -76.02 -47.25 25.58 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -174.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 18.6 t -69.75 -40.78 79.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.404 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 3.6 t80 -78.27 -31.34 49.01 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.009 -170.045 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -74.66 -31.05 61.81 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 119.897 1.226 . . . . 0.0 109.84 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.78 -56.48 17.58 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.556 2.3 p90 -76.55 -3.79 39.36 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 174.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 35.7 t -75.05 -35.11 61.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 122.07 -0.394 . . . . 0.0 111.357 177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.4 -15.46 36.85 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -80.69 -7.18 59.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.91 2.189 . . . . 0.0 116.91 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -179.54 -130.64 1.49 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 118.289 0.495 . . . . 0.0 111.963 -175.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -136.49 124.15 22.38 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.404 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.4 m -114.02 165.46 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -174.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -118.04 -61.49 1.67 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 408' ' ' LYS . . . . . 0.402 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 19.4 pttm -154.38 166.16 34.09 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.5 p -145.57 152.03 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 C-N-CA 124.604 1.162 . . . . 0.0 109.828 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -155.62 131.84 10.16 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.254 3.3 m-85 -82.73 164.03 20.92 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 116.871 2.175 . . . . 0.0 116.871 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.8 mmt -106.7 120.4 41.89 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.336 0.654 . . . . 0.0 112.44 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -79.1 -20.52 48.5 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.625 0.77 . . . . 0.0 111.31 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 42.3 t -81.45 -19.51 42.25 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.061 0.545 . . . . 0.0 112.355 -175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -115.64 157.87 43.28 Favored Pre-proline 0 N--CA 1.456 -0.156 0 C-N-CA 123.371 0.669 . . . . 0.0 109.759 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 -18.55 55.9 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.712 2.275 . . . . 0.0 110.791 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.64 103.82 0.17 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 176.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.36 162.37 33.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.802 0.841 . . . . 0.0 109.194 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.13 147.0 16.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 112.067 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 80.2 mtp -90.02 152.82 21.0 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.308 170.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.63 152.56 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 123.603 0.761 . . . . 0.0 110.228 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -136.31 130.35 32.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.595 0.634 . . . . 0.0 109.84 175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.0 mtp -151.0 171.22 17.63 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.449 0.7 . . . . 0.0 109.14 -169.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.52 123.27 19.2 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -72.61 -33.43 66.67 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -167.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.9 -88.66 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -72.27 -26.47 62.0 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -175.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.15 -34.23 15.94 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.265 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.18 -24.44 6.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 118.096 -1.442 . . . . 0.0 109.155 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -67.6 -50.41 58.38 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.527 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -65.18 -38.88 91.9 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.53 -37.51 85.17 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.785 0.72 . . . . 0.0 109.987 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 57.8 mt -77.45 -9.08 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.453 0.701 . . . . 0.0 111.713 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 76.7 m -102.85 -15.52 16.19 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -133.11 -24.81 1.84 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 -169.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.5 mp -133.98 -12.33 2.55 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.385 1.448 . . . . 0.0 113.329 -172.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -70.97 101.15 2.12 Favored 'General case' 0 C--O 1.206 -1.208 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -169.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.1 m-80 77.1 22.07 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 124.518 3.326 . . . . 0.0 113.669 -161.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.12 162.94 20.1 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 167.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -81.21 138.61 35.8 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.3 ttt -153.74 137.85 16.45 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.46 0.704 . . . . 0.0 109.71 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.5 m-85 57.46 21.53 7.07 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.95 7.33 66.15 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.44 -0.644 . . . . 0.0 113.089 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -149.91 154.27 38.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.03 0.915 . . . . 0.0 110.579 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -73.96 146.21 44.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.996 0.518 . . . . 0.0 111.818 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -125.12 84.45 2.28 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.243 1.017 . . . . 0.0 108.814 175.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.5 m120 -55.16 128.39 33.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.756 -170.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.0 t -126.99 149.0 31.76 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 C-N-CA 113.486 -3.286 . . . . 0.0 115.848 168.545 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.6 t -160.28 170.7 20.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.554 1.542 . . . . 0.0 107.763 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.1 148.87 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 20.6 t -83.36 166.47 18.41 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 122.983 0.513 . . . . 0.0 110.634 177.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.86 11.69 10.41 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -85.15 152.84 59.14 Favored Pre-proline 0 CA--C 1.532 0.259 0 C-N-CA 123.46 0.704 . . . . 0.0 110.22 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -65.49 -46.57 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.888 2.392 . . . . 0.0 112.468 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -170.02 160.29 8.13 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.902 0.881 . . . . 0.0 109.751 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.402 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 69.8 mt -77.91 143.08 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.2 mtp -114.16 134.12 22.26 Favored Pre-proline 0 N--CA 1.454 -0.236 0 O-C-N 122.407 -0.183 . . . . 0.0 111.033 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.38 161.47 40.17 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.497 2.798 . . . . 0.0 109.282 174.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 159.76 -132.15 2.91 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -72.47 161.79 30.34 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.892 0.477 . . . . 0.0 110.021 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.0 p -149.3 168.78 22.4 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.341 0.656 . . . . 0.0 110.03 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -129.34 -1.25 5.05 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.49 -178.95 46.98 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 -178.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.79 159.43 42.88 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.162 0.985 . . . . 0.0 109.453 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -76.7 -9.28 58.56 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -120.62 24.93 10.05 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.611 0.764 . . . . 0.0 110.249 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.89 -152.97 9.34 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.0 m -133.01 -12.67 2.85 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 178.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 19.4 p -127.04 150.86 49.25 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.274 0.63 . . . . 0.0 111.924 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.2 p -99.8 4.74 45.44 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.334 0.653 . . . . 0.0 110.884 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -141.6 148.24 38.91 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.374 1.47 . . . . 0.0 113.574 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -151.08 156.15 40.45 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 118.274 0.488 . . . . 0.0 111.291 -176.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -127.96 137.08 52.12 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -129.92 -1.78 4.69 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -68.22 -30.59 69.69 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.643 0.377 . . . . 0.0 111.749 -174.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -91.19 -2.72 57.45 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.683 0.393 . . . . 0.0 111.418 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 46.3 t -96.3 151.31 19.64 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.821 0.449 . . . . 0.0 111.927 -176.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -90.97 5.3 49.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.874 0.47 . . . . 0.0 111.183 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.05 -22.3 65.64 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.678 0.391 . . . . 0.0 111.656 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -60.71 137.7 58.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.905 0.482 . . . . 0.0 109.917 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 481' ' ' ARG . 48.7 tpt85 -72.12 -24.75 61.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.16 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.269 51.8 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 88.6 p -61.19 -22.16 64.49 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -169.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.59 157.72 67.44 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.48 -23.8 75.11 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.876 2.384 . . . . 0.0 111.298 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -80.96 -31.78 34.7 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -76.97 -28.11 55.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -73.45 -21.38 60.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 122.652 0.381 . . . . 0.0 110.72 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.9 -12.97 58.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.879 0.472 . . . . 0.0 111.895 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -123.97 16.53 9.3 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.966 0.507 . . . . 0.0 110.676 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 149.17 48.58 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 111.41 -174.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -145.6 130.46 18.17 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 30.1 mm -140.53 137.54 36.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 122.777 0.431 . . . . 0.0 110.153 -175.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -152.26 167.42 28.66 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.44 1.096 . . . . 0.0 109.624 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -64.74 157.61 73.38 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.63 148.61 92.63 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.37 2.047 . . . . 0.0 109.584 178.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -152.46 174.72 13.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -83.82 -7.66 59.4 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -86.76 140.24 16.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 112.328 173.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 14.4 tp -137.56 142.72 41.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -112.32 150.93 30.33 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.783 0.833 . . . . 0.0 109.406 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -146.46 160.22 42.37 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.456 0.646 . . . . 0.0 109.646 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -151.63 167.55 27.77 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 32.8 m120 53.28 55.71 8.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.612 0.365 . . . . 0.0 111.427 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.22 152.85 52.92 Favored Pre-proline 0 CA--C 1.531 0.217 0 C-N-CA 122.323 0.249 . . . . 0.0 110.454 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.15 152.4 38.06 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.152 2.568 . . . . 0.0 112.157 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.78 -16.4 63.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.97 0.508 . . . . 0.0 112.203 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -122.06 24.62 9.45 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.615 0.766 . . . . 0.0 110.897 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.74 -13.23 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 -176.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.682 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.3 -178.37 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -166.484 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.682 ' H ' HG22 ' A' ' 510' ' ' THR . 23.0 pt-20 -20.23 -42.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.6 mt-10 -56.15 -49.24 74.52 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 172.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -87.17 -27.04 23.26 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 122.034 2.197 . . . . 0.0 106.732 -173.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -64.95 -39.92 94.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -70.53 -44.42 67.55 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -75.31 -26.56 58.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.085 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.3 mt -71.6 -37.38 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.044 0 CA-C-N 118.858 0.754 . . . . 0.0 110.203 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 94.5 m -67.3 -29.97 69.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.897 -0.502 . . . . 0.0 111.026 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -73.85 -28.98 61.86 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -78.36 -11.51 59.95 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.98 -4.88 12.52 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.173 0.589 . . . . 0.0 111.55 -179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.8 3.87 60.57 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 123.572 0.606 . . . . 0.0 112.82 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.94 157.13 5.46 Favored 'Isoleucine or valine' 0 C--N 1.339 0.129 0 CA-C-N 117.831 0.815 . . . . 0.0 112.813 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.53 144.5 55.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.575 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 55.3 ptt85 -80.81 149.43 67.32 Favored Pre-proline 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.63 148.3 65.57 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 123.058 2.505 . . . . 0.0 110.311 177.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.7 t -85.64 -21.01 28.62 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -146.84 154.64 41.57 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 122.978 0.511 . . . . 0.0 110.786 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 76.8 t -144.72 145.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 123.649 0.779 . . . . 0.0 109.913 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -152.85 143.63 22.85 Favored 'General case' 0 C--N 1.337 0.049 0 C-N-CA 123.002 0.521 . . . . 0.0 109.994 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -138.62 150.64 23.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.057 0 C-N-CA 123.43 0.692 . . . . 0.0 112.13 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -154.85 -178.72 7.42 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -178.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.8 t -134.06 -177.76 4.72 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.307 1.043 . . . . 0.0 109.77 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 99.76 9.82 48.44 Favored Glycine 0 CA--C 1.527 0.826 0 CA-C-O 119.746 -0.474 . . . . 0.0 111.97 -177.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -125.67 -26.07 3.58 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 117.659 0.729 . . . . 0.0 112.5 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.3 t -164.52 155.09 14.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.812 0.445 . . . . 0.0 110.587 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -103.43 -8.05 20.48 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.038 0.535 . . . . 0.0 110.532 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -78.47 -38.42 41.06 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 122.723 0.409 . . . . 0.0 112.055 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 58.4 m -156.06 167.7 29.57 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 111.399 -171.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -83.8 167.52 17.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.644 0.778 . . . . 0.0 110.825 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -151.52 160.21 43.79 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 124.322 1.049 . . . . 0.0 108.616 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.05 -168.46 41.6 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.833 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.02 160.27 22.32 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.507 0.723 . . . . 0.0 110.827 -179.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.4 mt -138.06 161.76 35.92 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.268 1.427 . . . . 0.0 107.921 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -151.64 147.41 26.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.244 -0.285 . . . . 0.0 110.873 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -125.03 173.54 8.62 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.722 1.209 . . . . 0.0 112.723 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -74.68 -7.55 53.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.8 t -158.98 158.26 32.89 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 122.484 0.314 . . . . 0.0 111.119 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -68.05 -27.91 66.93 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.501 0.32 . . . . 0.0 110.532 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 85.3 p -77.08 -23.77 51.89 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.273 0.229 . . . . 0.0 110.839 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -76.82 -35.51 57.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.248 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.19 -28.49 61.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 122.187 -0.321 . . . . 0.0 110.353 174.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.4 tp -73.09 -42.98 62.42 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.061 0.544 . . . . 0.0 111.17 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -70.2 -35.3 73.83 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -178.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.82 -21.85 63.35 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.57 -39.19 88.36 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.07 -26.94 73.63 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.761 -0.466 . . . . 0.0 112.309 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.347 10.6 m-85 -102.16 -1.23 31.83 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 119.437 3.125 . . . . 0.0 119.437 179.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 60.4 mt -135.79 -4.59 2.23 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.828 1.195 . . . . 0.0 114.137 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.92 143.89 47.54 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 119.962 1.255 . . . . 0.0 109.094 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.87 15.41 3.85 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.369 1.068 . . . . 0.0 113.341 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -70.06 139.04 52.55 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -73.93 136.9 43.33 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.822 -0.549 . . . . 0.0 111.942 -175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.4 mtm -83.57 152.56 24.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.894 0.478 . . . . 0.0 110.676 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -71.97 168.19 18.54 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -146.55 121.22 5.32 Favored Pre-proline 0 N--CA 1.454 -0.264 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.9 -22.74 31.02 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.106 2.538 . . . . 0.0 113.306 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -158.71 -5.95 0.08 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 114.544 1.312 . . . . 0.0 114.544 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -73.92 158.98 52.57 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.828 0.74 . . . . 0.0 111.714 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.87 -21.28 21.41 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.058 3.172 . . . . 0.0 112.396 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -152.63 151.82 27.59 Favored Pre-proline 0 N--CA 1.456 -0.171 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.66 165.26 30.66 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.933 3.089 . . . . 0.0 111.414 177.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.91 142.35 50.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 102.825 -3.028 . . . . 0.0 102.825 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.7 143.53 42.07 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.4 tt -89.05 152.22 21.8 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.601 1.16 . . . . 0.0 108.95 173.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' LYS . . . . . 0.405 ' HE2' " H1'" ' C' ' 2' ' ' ' C' . 0.1 OUTLIER -139.95 150.75 44.9 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.023 -0.423 . . . . 0.0 110.777 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.27 162.05 40.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 22.3 p -165.49 168.27 16.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -54.94 129.58 38.21 Favored 'General case' 0 N--CA 1.457 -0.09 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.7 t -81.16 148.57 29.51 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -114.04 8.21 17.0 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 169.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.98 158.91 21.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.068 0.947 . . . . 0.0 111.744 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -91.84 -3.41 56.1 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.489 -178.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -154.53 172.77 17.27 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.553 0.741 . . . . 0.0 110.541 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.97 23.36 1.37 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.972 0.909 . . . . 0.0 109.802 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.253 1.255 0 CA-C-O 117.427 -1.273 . . . . 0.0 110.515 -176.416 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.519 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.418 -2.878 1 O4'-C1'-N19 112.821 4.621 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C5'-C4'-C3' 110.261 -3.493 . 0.402 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.563 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C3'-C2'-C1' 104.633 3.481 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 1 C5'-C4'-C3' 107.854 -5.097 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.745 1 O4'-C1'-N19 113.56 5.36 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.492 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C5'-C4'-C3' 109.868 -3.754 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.405 " H1'" ' HE2' ' A' ' 576' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 O4'-C1'-N19 111.164 2.964 . 0.077 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.951 0 C3'-C2'-C1' 105.065 3.961 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.872 0 O4'-C1'-N19 110.796 2.596 . 0.122 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 1 C5'-C4'-C3' 108.592 -4.605 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.3 31.4 t80 . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 115.594 1.702 . . . . 0.0 115.594 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -69.42 173.69 36.21 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 112.387 -0.285 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.7 179.6 4.08 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 124.772 3.648 . . . . 0.0 110.942 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -142.99 157.24 44.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.89 0.476 . . . . 0.0 110.765 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.97 158.93 34.5 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.514 0.725 . . . . 0.0 110.948 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -73.74 -4.39 34.27 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -158.08 147.91 15.33 Favored Pre-proline 0 N--CA 1.456 -0.131 0 C-N-CA 123.177 0.591 . . . . 0.0 110.035 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.27 -15.22 47.47 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.908 2.406 . . . . 0.0 110.322 174.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.5 t -91.26 154.79 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.583 0.753 . . . . 0.0 112.752 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.8 tt -140.41 152.07 45.42 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 125.152 1.381 . . . . 0.0 108.297 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -134.8 134.34 40.76 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.452 0.301 . . . . 0.0 111.033 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -129.91 152.71 37.78 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.069 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.495 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 3.7 m-85 -142.96 173.75 11.28 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -178.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 86.62 11.29 71.56 Favored Glycine 0 CA--C 1.527 0.808 0 O-C-N 122.242 -0.286 . . . . 0.0 112.48 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 41.2 mt -76.3 39.68 0.2 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.739 0.816 . . . . 0.0 110.998 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -74.34 18.67 0.15 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -136.98 156.27 48.65 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.943 0.497 . . . . 0.0 111.439 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 36.6 t -69.19 -15.38 63.38 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.52 0.728 . . . . 0.0 111.883 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -74.28 5.01 4.91 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 91.0 mmm -114.18 141.37 47.6 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.301 0.501 . . . . 0.0 110.782 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -162.36 168.02 22.83 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.568 1.147 . . . . 0.0 108.963 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 95.1 m -54.83 -32.11 60.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.902 0.481 . . . . 0.0 111.981 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.36 -38.6 60.0 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -66.39 -48.3 70.55 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -177.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.23 -49.41 84.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.422 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.268 1.4 m-85 -61.14 -56.87 15.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 178.025 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -57.44 -33.81 68.31 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.792 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.21 -64.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.572 0.5 OUTLIER -76.56 -5.52 48.01 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 176.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 50.5 t -74.77 -32.24 62.0 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.5 pp -63.3 -17.6 62.71 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.629 172.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -91.73 -8.83 45.8 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.73 -179.26 41.7 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 118.375 0.534 . . . . 0.0 112.455 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -80.67 129.99 34.84 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 122.599 -0.353 . . . . 0.0 110.958 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 0.8 OUTLIER -114.05 165.55 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.451 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -129.29 -63.34 0.95 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -154.42 158.81 40.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.295 0.952 . . . . 0.0 113.157 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 409' ' ' VAL . . . . . 0.41 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.5 p -138.52 150.94 24.09 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 C-N-CA 123.908 0.883 . . . . 0.0 110.267 -175.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -150.78 122.14 7.86 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.964 0.906 . . . . 0.0 110.417 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.259 6.6 m-85 -80.51 155.43 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 177.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 mmt -100.26 115.96 31.13 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.783 0.433 . . . . 0.0 110.949 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -79.15 -14.26 59.21 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.69 0.396 . . . . 0.0 111.341 172.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.7 p -85.0 -5.48 59.35 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.322 0.649 . . . . 0.0 112.251 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -126.21 156.73 71.83 Favored Pre-proline 0 CA--C 1.529 0.153 0 C-N-CA 123.554 0.741 . . . . 0.0 109.903 -177.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.63 -15.06 40.77 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.189 2.593 . . . . 0.0 111.592 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.19 92.07 0.08 OUTLIER Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.99 159.72 41.75 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.38 166.7 32.65 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.276 0.56 . . . . 0.0 110.578 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 41.1 ttp -129.49 147.43 51.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.275 1.03 . . . . 0.0 109.065 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.67 157.05 20.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -137.17 133.83 35.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 26.3 mtm -153.02 177.96 10.22 Favored 'General case' 0 C--O 1.23 0.078 0 C-N-CA 123.934 0.894 . . . . 0.0 109.957 -173.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.09 118.64 10.13 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 171.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -72.3 -33.3 67.3 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -168.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.69 -86.21 0.02 OUTLIER Glycine 0 C--N 1.335 0.524 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -177.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -74.5 -28.53 61.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.81 -34.06 18.4 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.984 -174.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.4 t -88.76 -23.99 6.17 Favored 'Isoleucine or valine' 0 C--N 1.341 0.225 0 C-N-CA 118.828 -1.149 . . . . 0.0 109.47 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.83 -52.06 33.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.943 174.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -68.17 -32.7 73.13 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 121.874 -0.516 . . . . 0.0 112.386 -176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.67 -34.19 75.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 118.721 0.691 . . . . 0.0 110.584 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.53 -12.69 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.31 0.644 . . . . 0.0 110.731 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.7 m -92.42 -21.24 20.31 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -128.6 -28.17 2.53 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.72 -15.16 7.99 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 120.486 1.494 . . . . 0.0 114.447 -172.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.646 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 32.5 p-10 -71.63 100.82 2.38 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 116.83 2.159 . . . . 0.0 116.83 -167.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.624 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 12.1 m-80 76.84 21.95 1.14 Allowed 'General case' 0 N--CA 1.482 1.144 0 O-C-N 117.743 -3.098 . . . . 0.0 113.199 -161.464 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -81.03 163.13 23.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.873 -1.142 . . . . 0.0 108.769 167.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -82.62 140.94 32.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.9 ttt -159.7 138.7 10.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.09 0.556 . . . . 0.0 110.15 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.419 46.4 m-85 57.03 20.71 5.64 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.91 70.67 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -134.19 -167.58 1.98 Allowed 'General case' 0 C--O 1.231 0.092 0 C-N-CA 124.326 1.05 . . . . 0.0 108.866 177.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -129.71 143.08 50.65 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.8 ptm -118.02 84.59 2.2 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.991 0.517 . . . . 0.0 110.393 -177.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 2.7 m-20 -54.44 128.4 31.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.779 -173.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.646 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.441 2.3 t -126.19 154.38 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 113.286 -3.366 . . . . 0.0 115.848 168.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 45.8 t -162.99 166.79 23.34 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.477 1.511 . . . . 0.0 108.716 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 10.2 t -68.61 145.16 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 O-C-N 121.855 -0.528 . . . . 0.0 112.084 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.4 t -84.41 155.99 22.01 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.635 0.374 . . . . 0.0 111.144 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.416 ' HE3' ' C6 ' ' B' ' 2' ' ' ' C' . 16.5 ptpt -96.54 -9.62 29.1 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.51 -0.119 . . . . 0.0 110.711 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -76.31 148.51 80.77 Favored Pre-proline 0 N--CA 1.454 -0.264 0 C-N-CA 123.404 0.682 . . . . 0.0 110.658 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.22 -32.87 3.79 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.364 2.71 . . . . 0.0 111.617 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.81 157.89 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.286 0.634 . . . . 0.0 110.671 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 17.7 mt -82.58 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 49.7 mmm -93.9 119.78 66.54 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 122.476 0.31 . . . . 0.0 110.382 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.49 154.47 45.13 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.213 2.609 . . . . 0.0 109.337 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 154.53 -113.06 0.55 Allowed Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.38 163.49 27.91 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.499 0.666 . . . . 0.0 111.905 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 14.7 t -157.37 160.12 38.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.44 1.096 . . . . 0.0 109.632 -177.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -130.07 0.73 4.72 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.39 175.07 44.76 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 93.8 mt -143.41 157.03 44.79 Favored 'General case' 0 N--CA 1.458 -0.074 0 C-N-CA 124.235 1.014 . . . . 0.0 109.179 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -75.6 -8.04 55.77 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . 0.253 11.9 t0 -120.49 26.89 8.89 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 122.039 0.923 . . . . 0.0 112.665 175.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.51 -150.83 7.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 69.4 m -133.05 -16.9 2.45 Favored 'General case' 0 N--CA 1.458 -0.07 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.9 m -127.04 149.14 50.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.863 0.465 . . . . 0.0 111.368 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.9 p -89.77 7.19 38.15 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 110.137 173.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -139.77 148.64 42.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.993 1.317 . . . . 0.0 113.275 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -154.7 158.2 39.23 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.05 0.387 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -127.7 136.65 51.86 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -134.07 4.66 3.52 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -179.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -64.85 -22.01 66.91 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.127 0.571 . . . . 0.0 112.046 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -114.02 1.21 14.59 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.05 0.54 . . . . 0.0 111.777 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.9 m -75.73 149.81 37.96 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.023 0.44 . . . . 0.0 111.53 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -80.12 -11.14 59.78 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.157 0.583 . . . . 0.0 111.151 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -62.05 -23.93 66.78 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.155 0.582 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -60.89 128.68 37.68 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.832 0.453 . . . . 0.0 110.27 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -73.18 -33.64 65.54 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.349 61.0 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -63.87 -21.95 66.69 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -173.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -135.19 150.5 72.95 Favored Pre-proline 0 C--O 1.23 0.071 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.6 -25.45 24.69 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.24 2.627 . . . . 0.0 111.412 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -80.03 -22.55 42.26 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.01 -0.431 . . . . 0.0 110.509 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -82.21 -41.65 20.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 172.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.26 -20.08 63.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.653 0.381 . . . . 0.0 111.858 -178.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.65 -19.71 48.45 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.472 0.309 . . . . 0.0 111.759 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -123.97 2.25 8.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -61.44 156.34 19.5 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.482 0.583 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -140.03 137.13 34.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -175.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.3 mm -141.12 144.02 27.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 123.595 0.758 . . . . 0.0 109.119 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -147.93 167.87 23.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.554 0.741 . . . . 0.0 111.086 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -63.0 155.36 73.07 Favored Pre-proline 0 N--CA 1.455 -0.196 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 172.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -66.01 135.49 41.0 Favored 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.191 1.927 . . . . 0.0 108.456 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -154.12 173.71 15.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.77 0.428 . . . . 0.0 110.076 -172.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -83.79 -8.77 59.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.7 -0.19 . . . . 0.0 111.161 -178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.64 138.04 20.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.2 tp -139.18 151.22 46.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -123.02 149.37 44.44 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.771 0.828 . . . . 0.0 108.906 -178.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -143.99 159.13 43.13 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -152.55 167.76 27.77 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.363 -2.458 . . . . 0.0 104.363 -176.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 60.61 57.53 2.71 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.174 0.59 . . . . 0.0 112.231 -173.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -136.08 122.46 14.02 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-O 119.442 -0.314 . . . . 0.0 111.186 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.67 164.1 1.06 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.944 3.096 . . . . 0.0 113.279 172.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.42 -17.3 64.18 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.887 0.875 . . . . 0.0 112.062 -175.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -97.93 3.98 49.55 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 47.0 t -73.07 -18.17 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.3 m -55.38 -177.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 117.638 -1.172 . . . . 0.0 113.813 -165.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -18.84 -44.53 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.254 1.822 . . . . 0.0 114.834 -169.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.0 mt-10 -57.06 -48.23 79.05 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 173.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -87.64 -28.36 21.9 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 121.968 2.167 . . . . 0.0 106.323 -173.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -61.88 -35.81 79.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -75.84 -42.72 48.83 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.07 -22.3 42.42 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.477 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.6 mt -75.58 -45.01 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.126 0 CA-C-N 118.417 0.553 . . . . 0.0 110.648 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 30.7 p -68.32 -32.11 72.01 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.045 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -64.77 -39.28 93.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.834 0.349 . . . . 0.0 111.924 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.5 tp10 -71.39 -28.58 64.13 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.584 0.353 . . . . 0.0 111.272 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.75 -4.74 59.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.233 0.613 . . . . 0.0 111.691 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.6 27.85 56.31 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.829 -0.429 . . . . 0.0 112.219 175.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 6.0 p -129.73 152.58 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 C-N-CA 123.263 0.625 . . . . 0.0 112.027 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -68.64 152.93 44.69 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 121.203 0.525 . . . . 0.0 111.802 -175.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -82.24 156.23 69.14 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.81 0.844 . . . . 0.0 110.607 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.24 153.21 77.93 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.261 2.641 . . . . 0.0 111.108 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -84.78 -15.49 44.78 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.8 t -153.5 160.85 42.63 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.37 149.37 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 C-N-CA 123.311 0.645 . . . . 0.0 109.491 -176.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -147.07 143.91 28.68 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.103 0.961 . . . . 0.0 108.816 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 4.7 t -138.83 143.2 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.058 0 C-N-CA 122.877 0.471 . . . . 0.0 111.998 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -152.89 -175.23 5.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.8 p -146.12 -171.5 3.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.886 0.874 . . . . 0.0 110.28 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 102.2 -10.18 56.59 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 123.97 0.795 . . . . 0.0 111.908 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -89.87 -27.22 20.05 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 117.597 0.699 . . . . 0.0 111.648 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 83.5 p -165.83 163.86 18.72 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.447 0.699 . . . . 0.0 109.581 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -97.04 -4.21 40.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.716 0.406 . . . . 0.0 110.914 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.63 -40.6 48.77 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 89.2 p -163.21 170.6 17.5 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.14 0.495 . . . . 0.0 111.052 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.0 p -83.27 174.2 10.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.33 0.652 . . . . 0.0 110.186 177.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.9 p -153.74 162.41 41.26 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.35 -170.5 43.34 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.057 -177.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.08 160.39 22.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.484 0.713 . . . . 0.0 110.288 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -138.66 161.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.932 1.293 . . . . 0.0 108.367 177.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.75 148.73 28.9 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.28 -0.262 . . . . 0.0 111.099 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 21.3 m-90 -127.87 173.19 10.2 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.715 1.206 . . . . 0.0 112.343 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -75.19 -10.36 59.4 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.617 0.367 . . . . 0.0 110.459 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -157.93 160.73 37.9 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 121.735 -0.603 . . . . 0.0 111.118 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -74.1 -22.34 59.52 Favored 'General case' 0 CA--C 1.527 0.089 0 O-C-N 122.386 -0.196 . . . . 0.0 110.942 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 88.3 p -77.78 -27.29 50.19 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -71.51 -35.93 70.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.4 56.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.0 tp -78.23 -41.73 33.37 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.398 0.279 . . . . 0.0 111.409 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -68.59 -39.04 81.09 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.2 m -67.7 -28.42 67.66 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.4 tt -71.22 -36.88 72.02 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.19 -32.04 75.14 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 119.632 -0.538 . . . . 0.0 111.831 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.326 9.8 m-85 -100.69 -14.5 18.07 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 119.114 3.005 . . . . 0.0 119.114 177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.69 -14.53 14.79 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.972 0.806 . . . . 0.0 112.031 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -70.09 140.93 52.81 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.397 0.999 . . . . 0.0 109.073 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.7 t60 55.47 20.29 3.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.673 1.189 . . . . 0.0 112.856 -178.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.35 135.57 52.02 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -75.98 130.93 39.18 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.121 -0.362 . . . . 0.0 111.492 -176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 61.6 mtm -100.95 152.67 20.28 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 123.145 0.578 . . . . 0.0 111.421 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -64.76 160.25 20.56 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 169.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -149.89 119.03 3.77 Favored Pre-proline 0 CA--C 1.532 0.257 0 O-C-N 122.281 -0.262 . . . . 0.0 111.184 -176.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -81.28 -16.66 9.48 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.395 2.73 . . . . 0.0 111.956 175.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -87.19 -5.15 59.08 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -175.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 177.59 167.81 36.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.2 -22.31 22.45 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.775 2.983 . . . . 0.0 111.662 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -88.77 139.05 29.33 Favored Pre-proline 0 N--CA 1.455 -0.202 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -79.58 167.67 20.6 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 123.757 2.971 . . . . 0.0 111.946 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -128.83 142.35 51.0 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 170.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.281 0.6 OUTLIER -85.99 137.95 32.34 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -175.805 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.0 134.99 37.72 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.75 149.52 50.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 118.483 0.583 . . . . 0.0 110.574 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.53 162.49 39.93 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.864 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 21.9 p -163.73 170.82 16.45 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.398 0.679 . . . . 0.0 110.909 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -56.12 125.09 20.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.414 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 37.2 t -80.81 151.97 28.48 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.2 t -114.64 7.09 15.91 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.41 1.084 . . . . 0.0 113.767 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.83 163.95 20.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.148 0.979 . . . . 0.0 111.96 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -97.69 -2.84 40.48 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.608 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -154.55 170.27 21.87 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.518 0.727 . . . . 0.0 110.17 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.88 23.55 1.38 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.193 0.597 . . . . 0.0 110.45 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 117.627 -1.177 . . . . 0.0 110.74 -176.401 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.495 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.716 1 O4'-C1'-N19 112.464 4.264 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.416 ' C6 ' ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 O4'-C1'-N19 111.819 3.619 . 0.403 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C3'-C2'-C1' 104.851 3.724 . 0.231 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.904 1 C5'-C4'-C3' 108.751 -4.499 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.956 1 O4'-C1'-N19 112.286 4.086 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.558 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.813 0 C5'-C4'-C3' 109.997 -3.668 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C5'-C4'-C3' 110.578 -3.281 . 0.049 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.005 0 C3'-C2'-C1' 104.174 2.971 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.414 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 O4'-C1'-N19 110.936 2.736 . 0.24 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.863 1 C5'-C4'-C3' 108.05 -4.967 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.272 21.8 t80 . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.83 171.44 43.59 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -70.42 176.21 7.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.303 3.336 . . . . 0.0 110.848 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -146.57 159.8 42.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.311 0.645 . . . . 0.0 110.352 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.73 157.41 38.08 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.585 0.354 . . . . 0.0 111.234 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -79.62 -3.03 45.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.111 0.564 . . . . 0.0 110.544 -177.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 47.1 t -155.97 151.13 21.1 Favored Pre-proline 0 CA--C 1.532 0.267 0 O-C-N 121.498 -0.751 . . . . 0.0 111.341 -177.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.29 -4.3 3.95 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.473 3.449 . . . . 0.0 114.03 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 380' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 451' ' ' SER . 6.5 m -128.47 165.77 27.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.95 0.881 . . . . 0.0 109.892 -174.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.65 159.57 41.96 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.937 1.695 . . . . 0.0 107.733 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.6 ttt -143.59 138.89 29.38 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.538 0.608 . . . . 0.0 111.145 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -121.19 154.44 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -175.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.522 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 4.5 m-85 -142.44 171.09 14.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.1 13.13 72.23 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 122.141 -0.35 . . . . 0.0 112.302 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.28 28.34 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.747 0.819 . . . . 0.0 111.581 178.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -64.6 -26.33 68.36 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.424 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -76.84 149.44 36.17 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.064 0.459 . . . . 0.0 110.996 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.8 p -70.58 -6.73 38.73 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.615 0.766 . . . . 0.0 112.646 -176.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -77.95 -14.34 59.57 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.954 0.501 . . . . 0.0 112.021 -176.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 80.3 mmm -86.05 154.29 21.52 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.034 0.379 . . . . 0.0 111.23 -178.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -164.0 164.34 23.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.315 1.046 . . . . 0.0 108.509 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.0 p -64.03 -29.77 70.89 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.034 -0.416 . . . . 0.0 111.978 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.02 -26.86 36.09 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -70.96 -50.79 30.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.435 0.636 . . . . 0.0 109.606 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.15 -47.47 92.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 397' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.264 1.3 m-85 -63.25 -52.35 62.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 178.06 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -59.42 -33.86 71.77 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 120.16 1.346 . . . . 0.0 109.458 -172.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 15.0 t -62.48 -61.88 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.561 0.8 OUTLIER -76.51 -4.98 45.57 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 176.216 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 52.9 t -75.26 -32.57 61.11 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.6 pp -62.41 -19.55 63.56 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.561 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.43 -9.31 52.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 116.919 2.192 . . . . 0.0 116.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 159.12 178.29 32.99 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 118.298 0.499 . . . . 0.0 112.234 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -68.51 140.21 55.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.435 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 18.2 m -114.01 165.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.918 1.287 . . . . 0.0 109.339 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -137.47 -60.71 0.66 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.81 154.7 37.78 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 118.738 0.699 . . . . 0.0 112.855 -175.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.9 146.72 19.73 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 C-N-CA 123.181 0.592 . . . . 0.0 109.976 176.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.2 133.07 13.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.632 0.373 . . . . 0.0 110.555 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.271 11.8 m-85 -80.38 149.6 30.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.7 mmt -75.01 131.95 40.99 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.135 0.493 . . . . 0.0 111.553 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -79.24 -25.5 42.59 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.879 0.871 . . . . 0.0 111.827 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 94.8 p -101.94 -6.78 23.06 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -113.89 152.74 45.92 Favored Pre-proline 0 CA--C 1.529 0.171 0 CA-C-N 118.507 0.594 . . . . 0.0 110.193 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.34 -15.9 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.463 2.776 . . . . 0.0 112.168 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 179.84 91.3 0.08 OUTLIER Glycine 0 C--N 1.337 0.611 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.84 159.91 35.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.639 0.775 . . . . 0.0 109.308 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.11 142.04 18.07 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.747 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.6 ptm -91.39 150.43 21.28 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.4 t -138.86 151.28 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.558 0.743 . . . . 0.0 112.13 -173.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -131.89 132.82 43.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 84.9 mtp -155.2 172.91 17.38 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.463 0.705 . . . . 0.0 109.691 -171.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.88 112.07 3.59 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.264 -2.125 . . . . 0.0 105.264 169.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -72.46 -33.41 67.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -166.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.74 -87.42 0.01 OUTLIER Glycine 0 CA--C 1.52 0.351 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -74.52 -27.3 60.48 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.11 -34.39 17.92 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.798 -174.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 96.6 t -85.92 -25.85 6.47 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 118.525 -1.27 . . . . 0.0 108.576 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -63.89 -52.63 59.06 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.316 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -68.91 -31.89 71.13 Favored 'General case' 0 N--CA 1.457 -0.088 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.95 -34.58 78.43 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.559 0.618 . . . . 0.0 110.219 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 41.5 mt -77.92 -13.98 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.463 0.705 . . . . 0.0 110.926 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.9 m -91.97 -22.03 20.22 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.46 -20.24 3.32 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -169.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 63.9 mt -134.48 -14.56 2.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 33.1 p-10 -71.67 101.02 2.44 Favored 'General case' 0 C--O 1.198 -1.622 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 -169.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.596 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.3 m-80 76.87 22.06 1.12 Allowed 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.012 -2.93 . . . . 0.0 112.491 -161.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -85.79 162.93 18.45 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -78.72 141.94 37.48 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.8 ttt -162.03 137.85 7.61 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.262 0.625 . . . . 0.0 109.912 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.411 49.4 m-85 56.76 28.87 14.98 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.96 9.26 86.79 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -134.0 -167.67 1.99 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.036 1.334 . . . . 0.0 108.7 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -138.17 143.91 40.49 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.36 105.3 8.98 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.596 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 23.5 m-20 -64.08 132.02 49.25 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 115.709 -2.091 . . . . 0.0 111.729 -173.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.1 t -125.75 151.8 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 113.229 -3.388 . . . . 0.0 115.567 169.258 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -163.99 170.03 17.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.472 1.109 . . . . 0.0 108.568 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 5.5 t -69.85 144.31 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' SER . . . . . 0.449 ' HB3' HG23 ' A' ' 380' ' ' VAL . 15.9 t -87.66 153.88 21.03 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.057 0.543 . . . . 0.0 110.822 177.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.428 ' HE3' " H2'" ' B' ' 2' ' ' ' C' . 21.4 pttp -101.89 1.37 36.83 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -73.87 156.21 88.26 Favored Pre-proline 0 N--CA 1.454 -0.233 0 C-N-CA 123.272 0.629 . . . . 0.0 110.036 176.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -75.87 -42.69 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.667 2.245 . . . . 0.0 111.019 176.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -171.04 164.7 7.51 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 124.196 0.998 . . . . 0.0 109.457 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.09 137.72 21.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 7.8 mmm -107.33 132.6 20.84 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 122.542 0.337 . . . . 0.0 110.691 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.1 158.61 45.39 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.228 2.619 . . . . 0.0 109.105 173.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.82 -133.1 3.59 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.368 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -72.55 158.79 35.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.599 0.76 . . . . 0.0 110.75 -176.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -151.2 169.45 21.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.433 0.693 . . . . 0.0 109.766 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -122.65 1.68 9.47 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.51 -175.14 54.95 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.35 162.39 36.57 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 124.387 1.075 . . . . 0.0 109.165 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 11.0 pm0 -70.08 -22.01 63.09 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -120.49 13.41 11.76 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -159.04 167.13 34.8 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 121.986 -0.446 . . . . 0.0 112.17 -176.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 t -86.35 -29.79 22.7 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.782 0.433 . . . . 0.0 111.777 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 87.4 m -127.06 151.52 48.5 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.008 0.523 . . . . 0.0 111.639 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 84.4 p -82.24 7.27 14.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.262 0.625 . . . . 0.0 110.728 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -134.04 147.5 50.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.312 1.445 . . . . 0.0 114.824 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -152.63 153.45 33.36 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.883 0.473 . . . . 0.0 110.315 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.256 0.1 OUTLIER -133.98 145.73 49.78 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -127.33 10.78 6.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 34.6 t -65.33 -22.59 66.84 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.259 0.624 . . . . 0.0 111.91 -174.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -114.05 2.04 14.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.045 0.538 . . . . 0.0 111.637 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -77.32 146.51 36.71 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.766 0.317 . . . . 0.0 111.372 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -79.25 -8.21 58.86 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.393 0.277 . . . . 0.0 110.87 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -63.08 -21.66 66.33 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -59.04 123.35 16.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.566 0.346 . . . . 0.0 110.125 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -80.97 -32.6 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -176.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.285 55.1 m-85 -97.96 14.26 27.94 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.4 p -74.61 -6.67 49.89 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.28 149.83 69.05 Favored Pre-proline 0 C--O 1.23 0.059 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -71.4 -24.72 22.34 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 123.235 2.623 . . . . 0.0 111.301 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -81.37 -23.97 37.35 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.066 0.394 . . . . 0.0 110.751 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -82.84 -41.81 18.59 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 173.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.21 -18.18 64.27 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.462 0.305 . . . . 0.0 111.579 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.11 -18.9 52.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.757 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -2.54 8.14 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.54 152.6 41.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.872 0.76 . . . . 0.0 110.772 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.548 ' NH1' " H2'" ' C' ' 4' ' ' ' C' . 6.4 ptp180 -150.91 138.61 19.75 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.9 mt -139.78 145.66 26.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 123.829 0.851 . . . . 0.0 108.909 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -145.3 173.48 11.93 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.6 0.76 . . . . 0.0 110.523 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -56.99 154.3 19.79 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.088 0.555 . . . . 0.0 109.558 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -63.5 148.75 92.34 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.701 2.267 . . . . 0.0 110.097 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.1 t -152.57 167.39 29.01 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.804 -174.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.66 -0.69 51.73 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 122.315 -0.241 . . . . 0.0 111.051 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 3.0 t -97.57 134.53 35.28 Favored 'Isoleucine or valine' 0 C--O 1.231 0.084 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -117.51 157.76 25.73 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.865 0.866 . . . . 0.0 109.136 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -129.37 136.97 50.67 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.166 0.986 . . . . 0.0 108.37 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -125.82 158.07 35.94 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -177.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -147.63 165.52 30.16 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 103.656 -2.72 . . . . 0.0 103.656 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 504' ' ' ASN . . . . . 0.408 HD21 " H5'" ' C' ' 2' ' ' ' C' . 17.5 m120 57.95 57.42 4.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.882 0.473 . . . . 0.0 111.864 -175.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -126.55 152.56 74.63 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.345 0.658 . . . . 0.0 110.322 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.413 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 74.0 Cg_endo -68.72 162.59 40.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.728 2.286 . . . . 0.0 110.658 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.46 -16.56 63.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.202 0.601 . . . . 0.0 111.317 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -112.54 22.26 14.79 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.329 0.651 . . . . 0.0 111.388 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.3 p -65.93 -15.12 18.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -176.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.88 -177.23 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 117.793 -1.098 . . . . 0.0 113.863 -165.587 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.615 ' H ' HG22 ' A' ' 510' ' ' THR . 23.5 pt-20 -27.32 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -169.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.9 mt-10 -57.57 -47.86 80.93 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 117.545 -1.217 . . . . 0.0 114.244 170.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -86.0 -27.67 24.68 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-N 122.287 2.312 . . . . 0.0 106.346 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.52 -33.53 75.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 176.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -77.52 -41.19 40.1 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.13 -28.45 57.44 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.015 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 69.9 mt -73.32 -40.22 56.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.115 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.42 -30.17 70.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.83 -43.7 71.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -68.86 -22.08 64.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 O-C-N 122.17 -0.331 . . . . 0.0 111.837 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.88 -5.23 48.44 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.923 0.489 . . . . 0.0 111.321 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.08 4.73 60.18 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-O 119.655 -0.525 . . . . 0.0 113.782 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.02 162.44 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 CA-C-N 118.154 0.977 . . . . 0.0 112.98 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -73.34 143.86 46.74 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 174.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -71.92 149.3 92.47 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 122.823 0.449 . . . . 0.0 111.193 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.38 155.9 62.88 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.622 2.881 . . . . 0.0 110.733 177.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -86.0 -17.95 33.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.4 t -154.8 156.79 36.89 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.515 0.198 . . . . 0.0 110.995 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 96.5 t -145.06 145.6 20.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 123.879 0.872 . . . . 0.0 110.199 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -146.92 145.9 29.95 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 123.252 0.621 . . . . 0.0 109.833 175.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 7.9 t -143.7 144.55 23.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -177.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -153.78 -175.43 5.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 91.8 p -133.59 -178.99 5.25 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.543 0.737 . . . . 0.0 110.756 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 97.43 -7.22 63.69 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.862 0.744 . . . . 0.0 112.375 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -86.69 -34.84 19.6 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.715 0.757 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 39.7 t -167.18 158.39 12.0 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.963 0.505 . . . . 0.0 110.265 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -96.89 -7.97 32.03 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.2 -28.85 19.7 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.433 0.693 . . . . 0.0 111.549 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.9 p -160.56 155.91 24.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.245 0.545 . . . . 0.0 112.044 -178.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.5 t -84.22 171.98 12.29 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 66.7 m -146.75 163.64 35.32 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.631 1.172 . . . . 0.0 109.455 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.98 -173.11 46.05 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.61 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -122.39 160.39 25.55 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.597 0.759 . . . . 0.0 110.828 -177.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 70.4 mt -139.54 158.94 43.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.835 1.254 . . . . 0.0 108.48 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -150.76 147.5 27.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.936 0.335 . . . . 0.0 111.569 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -122.81 169.27 11.28 Favored 'General case' 0 C--N 1.338 0.073 0 C-N-CA 124.867 1.267 . . . . 0.0 112.633 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -76.42 -8.24 56.72 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.887 0.475 . . . . 0.0 110.861 -176.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.9 t -156.26 158.44 37.52 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 121.708 -0.62 . . . . 0.0 111.165 -178.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.01 -30.01 67.22 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.384 0.273 . . . . 0.0 111.192 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 71.8 m -79.34 -26.33 42.14 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 110.483 -0.192 . . . . 0.0 110.483 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -72.52 -30.98 64.97 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 121.042 0.449 . . . . 0.0 111.355 174.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.92 -28.04 55.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.864 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 51.6 tp -79.93 -35.2 38.11 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.439 0.296 . . . . 0.0 111.455 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -74.41 -38.35 63.1 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.725 -0.609 . . . . 0.0 109.414 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.263 0.3 OUTLIER -72.45 -21.41 61.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 175.38 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.64 -36.05 78.08 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 170.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.42 -43.96 95.99 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.253 6.6 m-85 -85.64 -18.63 32.69 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -106.56 -12.76 15.51 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.935 0.789 . . . . 0.0 112.396 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -74.98 141.05 44.03 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.239 0.927 . . . . 0.0 109.269 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 55.07 19.24 2.67 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.294 1.037 . . . . 0.0 112.636 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.253 39.9 t80 -73.24 139.2 46.05 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -72.5 125.42 27.39 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 122.309 0.243 . . . . 0.0 110.868 -176.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 564' ' ' MET . . . . . 0.413 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 75.3 mtm -83.52 152.69 24.78 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.686 0.395 . . . . 0.0 111.926 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -64.23 157.64 25.29 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -146.85 58.69 4.52 Favored Pre-proline 0 CA--C 1.533 0.29 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -177.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -69.69 1.59 4.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.88 3.053 . . . . 0.0 111.947 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -142.38 24.68 1.92 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.372 0.669 . . . . 0.0 110.626 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -150.88 154.64 25.71 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -72.6 -22.3 21.1 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.882 3.055 . . . . 0.0 111.987 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -151.81 150.46 26.22 Favored Pre-proline 0 N--CA 1.455 -0.191 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.0 160.12 43.53 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.948 3.099 . . . . 0.0 111.717 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -129.92 142.39 50.66 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 102.677 -3.083 . . . . 0.0 102.677 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.258 0.7 OUTLIER -77.37 138.37 39.27 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 179.078 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.3 tt -83.14 151.85 25.54 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.42 150.42 47.63 Favored 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.546 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -157.25 165.15 36.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 111.184 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 28.8 p -158.99 170.37 22.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.45 0.7 . . . . 0.0 109.713 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -56.48 125.71 23.26 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 177.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.1 t -86.64 152.42 22.59 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -169.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -111.7 10.13 20.98 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.34 14.18 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 124.046 0.938 . . . . 0.0 111.836 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.8 mm-40 -92.01 -3.92 55.19 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.98 178.36 3.44 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.636 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.76 32.01 1.43 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.349 0.26 . . . . 0.0 111.63 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.43 -1.271 . . . . 0.0 110.701 -178.959 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.522 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.73 0 O4'-C1'-N19 112.002 3.802 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.428 " H2'" ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C5'-C4'-C3' 110.867 -3.088 . 0.346 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.594 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.793 1 O4'-C1'-N19 112.947 4.747 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.842 0 C5'-C4'-C3' 110.844 -3.104 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . 0.421 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 1 O4'-C1'-N19 112.865 4.665 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.527 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 C5'-C4'-C3' 109.807 -3.796 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.408 " H5'" HD21 ' A' ' 504' ' ' ASN . . . . . . . . 0 O4'--C4' 1.42 -2.769 0 O4'-C1'-N19 111.404 3.204 . 0.076 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C3'-C2'-C1' 104.742 3.602 . 0.062 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.548 " H2'" ' NH1' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.422 -2.572 1 O4'-C1'-N19 112.719 4.519 . 0.049 4b . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.576 1 C5'-C4'-C3' 107.371 -5.419 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.299 42.5 t80 . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 155.81 173.44 24.45 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.75 165.96 30.38 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 124.025 3.15 . . . . 0.0 109.825 176.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 375' ' ' HIS . . . . . 0.401 ' HA ' ' HA2' ' A' ' 426' ' ' GLY . 41.1 p-80 -154.63 157.91 38.9 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.321 0.581 . . . . 0.0 112.182 -178.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.64 166.24 23.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.95 0.9 . . . . 0.0 111.391 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.22 -8.28 53.89 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -159.49 147.35 13.28 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 122.725 0.41 . . . . 0.0 110.985 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -13.75 36.16 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 123.565 2.843 . . . . 0.0 110.965 173.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -86.22 146.43 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -134.88 155.04 51.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.5 1.12 . . . . 0.0 108.488 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.31 134.83 34.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -174.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.07 150.46 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.097 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.426 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 7.5 m-85 -139.96 176.31 8.85 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 105.254 -2.128 . . . . 0.0 105.254 -177.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 81.74 11.84 82.31 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 116.417 -0.356 . . . . 0.0 112.426 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 62.7 mt -79.29 22.76 0.41 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.652 0.726 . . . . 0.0 112.131 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -65.17 -25.64 67.82 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -175.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.439 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.1 pm0 -66.92 157.06 34.19 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.395 0.617 . . . . 0.0 111.599 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 81.6 p -79.05 27.39 0.24 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.75 1.22 . . . . 0.0 112.23 -172.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.87 4.23 4.15 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.294 0.638 . . . . 0.0 112.696 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 39.9 mmm -102.37 141.89 34.46 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.729 0.3 . . . . 0.0 110.201 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -154.27 152.64 30.53 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.211 0.604 . . . . 0.0 109.47 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -57.68 -37.07 72.83 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -71.3 -38.47 71.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.247 0.476 . . . . 0.0 112.184 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -76.02 -45.58 33.76 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.147 0.579 . . . . 0.0 112.233 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.61 -42.36 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -75.91 -29.93 58.59 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.764 -170.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 0.4 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 2.0 p30 -76.97 -30.88 56.18 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.893 1.224 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.54 -55.75 19.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 N-CA-C 106.405 -1.702 . . . . 0.0 106.405 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.541 5.4 p90 -76.6 -4.91 45.41 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 173.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 49.9 t -74.63 -30.52 61.68 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.924 -0.485 . . . . 0.0 110.624 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.0 pp -62.34 -16.3 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.301 -0.559 . . . . 0.0 111.152 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -87.53 -7.33 57.7 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.55 -172.28 44.84 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.226 -178.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -85.03 121.04 27.23 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.082 0.553 . . . . 0.0 109.816 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.5 9.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -130.16 -59.92 1.03 Allowed 'General case' 0 C--N 1.339 0.144 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -144.14 169.77 17.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.859 1.208 . . . . 0.0 112.51 -177.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.0 p -147.24 144.13 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 125.057 1.343 . . . . 0.0 108.24 175.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -154.39 124.16 6.67 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 117.961 0.346 . . . . 0.0 111.438 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.263 5.9 m-85 -72.68 155.24 40.2 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 35.9 mmt -84.92 128.73 34.75 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.271 0.629 . . . . 0.0 111.64 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -18.29 53.29 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 84.1 p -101.95 1.59 36.91 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -126.89 152.03 74.74 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 118.342 0.519 . . . . 0.0 110.623 -175.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.0 -15.6 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.535 2.823 . . . . 0.0 111.441 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.63 94.96 0.1 OUTLIER Glycine 0 C--N 1.338 0.66 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.54 160.0 31.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.651 0.78 . . . . 0.0 109.208 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.15 144.67 14.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 77.6 mtp -84.7 154.2 22.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.712 0.805 . . . . 0.0 109.335 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 38.1 t -147.48 152.12 13.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -134.21 139.88 46.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.114 -0.366 . . . . 0.0 110.06 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.4 ptp -164.14 172.49 13.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.273 1.029 . . . . 0.0 110.047 -174.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.33 126.77 28.55 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.91 -34.03 66.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -169.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 426' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 375' ' ' HIS . . . -58.68 -85.79 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -178.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -64.15 -37.42 87.41 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.46 -35.96 17.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.401 -0.809 . . . . 0.0 112.876 -171.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.2 t -83.18 -28.29 7.87 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 CA-C-N 120.242 1.383 . . . . 0.0 109.153 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -68.71 -47.29 66.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.753 177.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -68.12 -36.87 80.43 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -176.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.69 77.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.944 0.793 . . . . 0.0 109.814 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 46.9 mt -76.48 -14.81 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 122.826 0.45 . . . . 0.0 110.85 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 55.4 m -97.24 -17.42 19.84 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -130.27 -26.13 2.37 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 116.29 1.959 . . . . 0.0 116.29 -169.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.61 -11.09 2.4 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 120.532 1.515 . . . . 0.0 114.27 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.633 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 36.5 p-10 -71.96 101.18 2.62 Favored 'General case' 0 C--O 1.198 -1.615 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 -168.091 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 7.4 m-80 77.19 21.47 1.08 Allowed 'General case' 0 N--CA 1.483 1.221 0 O-C-N 117.381 -3.325 . . . . 0.0 112.763 -163.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.21 159.67 28.4 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.536 -0.728 . . . . 0.0 110.002 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -74.33 136.79 42.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 115.675 1.731 . . . . 0.0 115.675 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -157.96 140.9 14.94 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.351 0.661 . . . . 0.0 109.531 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 59.44 17.5 6.03 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.73 10.22 85.42 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -174.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -132.39 -162.26 1.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.509 1.523 . . . . 0.0 108.31 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -135.36 146.97 48.91 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 122.646 0.378 . . . . 0.0 110.812 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.63 99.93 5.34 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 176.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -65.22 131.33 46.22 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 115.746 -2.073 . . . . 0.0 112.487 -171.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.633 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.449 2.1 t -125.91 152.13 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 112.62 -3.632 . . . . 0.0 115.809 168.414 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.8 t -162.96 171.26 16.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.778 1.231 . . . . 0.0 108.462 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.2 p -76.18 146.95 8.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.2 t -86.33 156.86 20.05 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.066 0.547 . . . . 0.0 111.01 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -92.55 -8.51 44.17 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 111.179 0.066 . . . . 0.0 111.179 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -77.49 150.43 79.55 Favored Pre-proline 0 CA--C 1.529 0.144 0 C-N-CA 123.458 0.703 . . . . 0.0 110.637 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.58 -32.95 1.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.411 2.74 . . . . 0.0 112.484 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.03 159.89 11.57 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.364 0.666 . . . . 0.0 110.343 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 39.1 mt -91.09 122.68 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 39.1 mmm -76.11 160.48 78.12 Favored Pre-proline 0 N--CA 1.456 -0.158 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 170.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -49.11 117.56 2.92 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.752 2.301 . . . . 0.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -78.49 135.44 15.83 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 -169.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -78.32 164.13 25.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 168.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 33.4 t -143.78 159.12 43.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.961 0.8 . . . . 0.0 112.966 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -143.91 2.98 1.22 Allowed 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -177.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.4 -178.83 53.33 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 123.332 0.491 . . . . 0.0 112.009 -176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.7 mt -143.53 158.7 43.45 Favored 'General case' 0 C--N 1.334 -0.099 0 C-N-CA 123.631 0.772 . . . . 0.0 109.109 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -68.73 -14.26 62.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.21 0.204 . . . . 0.0 111.428 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -120.43 27.25 8.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.694 0.798 . . . . 0.0 111.536 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -176.58 -154.46 11.83 Favored Glycine 0 C--N 1.337 0.613 0 O-C-N 121.549 -0.719 . . . . 0.0 111.35 -178.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -132.97 -11.43 2.96 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.0 t -127.08 156.03 42.36 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.036 0.534 . . . . 0.0 110.279 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.1 p -122.7 3.74 9.52 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.598 0.759 . . . . 0.0 112.304 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -142.92 141.73 31.55 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 124.818 1.247 . . . . 0.0 114.331 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -155.13 156.68 36.21 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.963 -0.46 . . . . 0.0 111.382 -177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -119.84 132.54 55.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.695 1.198 . . . . 0.0 112.943 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -122.25 3.39 9.79 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 98.0 p -68.9 -17.57 63.99 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.568 0.347 . . . . 0.0 111.299 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -113.96 -1.58 13.77 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.306 0.642 . . . . 0.0 111.594 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.3 t -75.22 146.98 40.72 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.405 0.282 . . . . 0.0 110.941 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -76.29 -17.37 59.48 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.455 0.302 . . . . 0.0 110.792 178.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -65.74 -23.62 66.78 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.486 0.315 . . . . 0.0 110.787 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -68.49 113.55 6.13 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' ARG . . . . . 0.582 HH11 ' HG2' ' A' ' 481' ' ' ARG . 6.8 ttt-85 -81.08 -29.96 34.82 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 116.818 -0.173 . . . . 0.0 111.409 -172.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -89.01 7.46 34.68 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.1 t -71.38 -18.93 62.33 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.19 149.93 71.39 Favored Pre-proline 0 C--O 1.232 0.137 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.13 -24.52 27.91 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.026 2.484 . . . . 0.0 111.681 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -81.35 -22.68 38.24 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.164 0.438 . . . . 0.0 110.9 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.56 -39.21 17.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 122.097 -0.377 . . . . 0.0 110.019 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -69.01 -20.47 64.15 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.116 0.566 . . . . 0.0 111.443 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.42 -16.96 60.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.068 -0.395 . . . . 0.0 111.732 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -124.09 31.64 5.76 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.118 0.567 . . . . 0.0 111.773 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.89 156.84 6.2 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.311 0.577 . . . . 0.0 112.034 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.408 ' HG2' ' C6 ' ' C' ' 4' ' ' ' C' . 0.5 OUTLIER -144.23 97.58 3.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 179.711 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.5 mm -137.12 136.9 47.08 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.04 0 C-N-CA 122.845 0.458 . . . . 0.0 110.096 -174.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -152.09 173.42 14.93 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 110.21 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -57.28 156.58 14.69 Favored Pre-proline 0 CA--C 1.531 0.22 0 C-N-CA 123.454 0.702 . . . . 0.0 109.928 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.13 150.82 87.54 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 122.947 2.431 . . . . 0.0 110.007 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.0 t -155.07 166.54 33.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 -174.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -83.71 -0.91 52.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.656 0.382 . . . . 0.0 110.55 179.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -96.27 138.19 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 177.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.1 mt -123.14 155.01 37.87 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.07 0.548 . . . . 0.0 109.662 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -119.14 142.12 48.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -136.55 158.94 43.25 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 121.506 0.67 . . . . 0.0 110.2 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -150.9 168.76 23.52 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 104.181 -2.526 . . . . 0.0 104.181 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 57.54 57.51 4.29 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.864 0.465 . . . . 0.0 110.847 -174.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -135.54 110.54 10.45 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.356 0.262 . . . . 0.0 110.826 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.66 165.78 1.59 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 124.693 3.595 . . . . 0.0 113.162 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 16.4 mt -68.37 -16.46 63.93 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.006 -176.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.93 -10.6 50.07 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -81.61 -13.88 12.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -171.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.86 178.89 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -167.405 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.702 ' H ' HG22 ' A' ' 510' ' ' THR . 87.1 tt0 4.56 -64.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.541 1.936 . . . . 0.0 114.671 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.3 mt-10 -57.06 -43.0 81.62 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.9 -27.0 21.28 Favored 'General case' 0 C--N 1.35 0.6 0 CA-C-N 122.667 2.485 . . . . 0.0 105.712 -176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -60.12 -37.64 80.63 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.63 -1.228 . . . . 0.0 113.275 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.57 -49.67 52.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -79.61 -21.42 44.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.83 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 57.0 mt -71.93 -40.4 68.2 Favored 'Isoleucine or valine' 0 C--N 1.338 0.099 0 CA-C-N 119.006 0.821 . . . . 0.0 109.589 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 98.7 m -64.58 -33.99 77.2 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.688 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -63.29 -40.26 96.87 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -73.73 -9.34 58.56 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.655 0.382 . . . . 0.0 111.997 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 87.9 mt -107.86 -2.66 19.67 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.452 0.701 . . . . 0.0 111.606 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.08 -13.23 5.83 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.593 -0.56 . . . . 0.0 113.431 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 35.4 m -81.48 154.8 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.088 0 CA-C-N 118.191 0.996 . . . . 0.0 109.26 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -75.8 148.73 38.22 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.062 -0.399 . . . . 0.0 111.336 -176.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 53.3 ptt85 -70.79 156.23 92.28 Favored Pre-proline 0 CA--C 1.53 0.177 0 C-N-CA 123.277 0.631 . . . . 0.0 109.936 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.26 151.29 83.8 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.238 2.625 . . . . 0.0 110.959 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.5 t -87.11 -14.95 39.88 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 23.2 t -151.46 154.86 37.41 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 122.489 0.316 . . . . 0.0 110.639 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 57.8 t -143.62 146.38 21.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 C-N-CA 123.702 0.801 . . . . 0.0 110.187 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -147.26 141.61 26.33 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.488 0.715 . . . . 0.0 109.476 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -137.37 149.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.75 -172.44 4.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 92.0 p -140.83 -177.25 4.99 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.54 0.736 . . . . 0.0 110.628 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.6 -8.76 66.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 123.825 0.726 . . . . 0.0 112.142 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.51 -27.01 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.83 0.815 . . . . 0.0 111.017 177.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 80.2 p -165.07 165.75 19.72 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.414 0.686 . . . . 0.0 109.619 176.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.4 pm0 -96.85 -5.72 37.58 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.057 0.543 . . . . 0.0 110.915 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -77.61 -47.43 19.35 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 88.1 p -163.05 172.65 14.65 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.145 0.498 . . . . 0.0 110.929 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 42.1 t -77.41 167.3 21.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.336 0.589 . . . . 0.0 111.174 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 91.9 p -148.48 163.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.32 -165.87 36.55 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 119.772 -1.204 . . . . 0.0 113.485 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.88 159.23 25.94 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.809 0.844 . . . . 0.0 110.474 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.1 mt -137.71 155.39 49.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.953 1.301 . . . . 0.0 108.134 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -145.8 147.42 31.84 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 118.147 0.43 . . . . 0.0 111.498 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -124.67 171.08 10.35 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.929 1.292 . . . . 0.0 112.075 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -73.07 -12.22 60.83 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 47.4 t -157.52 164.48 37.32 Favored 'General case' 0 C--O 1.231 0.119 0 O-C-N 121.806 -0.559 . . . . 0.0 111.097 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -70.78 -29.2 65.33 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.477 0.311 . . . . 0.0 110.713 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 82.3 p -76.25 -26.34 55.89 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 178.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.35 -36.93 74.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.968 0.507 . . . . 0.0 111.476 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.53 -28.51 56.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.465 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 52.0 tp -74.03 -40.88 62.57 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.23 -0.294 . . . . 0.0 111.235 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.64 -36.81 73.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.622 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 2.5 m -70.31 -27.71 64.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 176.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -65.23 -39.27 92.51 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.04 -47.22 75.33 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -84.51 -27.09 27.64 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 27.6 tp -93.66 -20.0 20.59 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -69.99 149.88 47.26 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.315 0.507 . . . . 0.0 110.211 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 57.31 22.65 7.98 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.738 1.215 . . . . 0.0 113.122 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -65.44 134.75 54.14 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 177.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -76.61 121.08 22.7 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.476 0.31 . . . . 0.0 110.707 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 68.3 mtm -90.4 152.62 20.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -66.72 162.83 20.44 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.131 0.573 . . . . 0.0 109.969 172.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -150.36 119.17 3.64 Favored Pre-proline 0 CA--C 1.532 0.285 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.03 -18.92 20.94 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.402 2.735 . . . . 0.0 114.164 -173.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -156.37 -5.76 0.11 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -177.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -74.7 157.8 50.87 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 118.715 0.689 . . . . 0.0 111.578 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.45 -19.86 28.12 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.786 2.991 . . . . 0.0 111.876 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -153.6 153.94 29.7 Favored Pre-proline 0 N--CA 1.455 -0.217 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.67 164.51 35.47 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.298 2.665 . . . . 0.0 111.002 176.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -129.94 142.32 50.66 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 102.997 -2.964 . . . . 0.0 102.997 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.25 0.8 OUTLIER -84.96 140.3 31.18 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 115.321 1.601 . . . . 0.0 115.321 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.7 tt -78.26 147.14 34.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.28 147.97 52.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.401 -0.519 . . . . 0.0 110.619 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.26 164.01 38.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.234 0.54 . . . . 0.0 111.245 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 24.6 p -162.24 175.33 11.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.269 1.028 . . . . 0.0 110.038 -178.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -57.97 125.83 24.82 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.9 t -81.83 150.64 27.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -172.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.27 0.7 OUTLIER -114.54 10.3 16.82 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.852 1.426 . . . . 0.0 114.852 169.836 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.63 163.4 21.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.215 1.006 . . . . 0.0 111.906 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -96.95 -0.78 46.96 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.437 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -155.09 168.56 26.61 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.629 0.772 . . . . 0.0 110.293 -178.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.92 20.46 1.44 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.492 0.717 . . . . 0.0 110.381 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.457 -1.259 . . . . 0.0 110.765 -175.564 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.426 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 O4'-C1'-N19 112.059 3.859 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 0 O4'-C1'-N19 111.567 3.367 . 0.429 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.535 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.953 0 O4'-C1'-N19 111.047 2.847 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C5'-C4'-C3' 110.296 -3.469 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . 0.424 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.893 1 O4'-C1'-N19 112.303 4.103 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.497 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 0 C3'-C2'-C1' 104.834 3.705 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C5'-C4'-C3' 110.818 -3.121 . 0.099 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.901 0 C3'-C2'-C1' 105.032 3.925 . 0.034 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.408 ' C6 ' ' HG2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.419 -2.822 0 O4'-C1'-N19 110.853 2.653 . 0.124 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 1 C5'-C4'-C3' 108.814 -4.458 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.285 17.5 t80 . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 66.67 49.66 53.97 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 119.334 -0.703 . . . . 0.0 112.584 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.35 163.15 37.54 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.618 2.878 . . . . 0.0 111.183 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -155.2 158.54 39.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.165 0.586 . . . . 0.0 110.422 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.83 160.61 31.88 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.873 0.368 . . . . 0.0 111.237 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -73.98 -6.6 48.34 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.3 t -158.85 146.93 13.7 Favored Pre-proline 0 N--CA 1.456 -0.138 0 C-N-CA 122.759 0.424 . . . . 0.0 110.49 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -12.74 34.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.492 2.795 . . . . 0.0 110.742 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.51 148.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 C-N-CA 122.846 0.458 . . . . 0.0 112.182 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.9 tt -140.28 155.71 46.74 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 14.5 tpt -139.05 131.61 28.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.241 0.473 . . . . 0.0 110.811 -174.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.26 155.12 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.479 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.2 m-85 -144.8 175.11 10.43 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -176.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.24 9.62 81.7 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.071 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.81 26.79 0.4 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.467 0.707 . . . . 0.0 112.461 -177.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.6 -40.74 97.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.462 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.43 148.61 51.62 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.122 0.487 . . . . 0.0 111.201 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 67.3 m -70.08 -8.02 46.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -72.93 -15.4 61.57 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 122.58 0.352 . . . . 0.0 111.455 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 51.6 mmm -90.72 148.0 22.88 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.924 0.392 . . . . 0.0 110.814 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -162.23 159.75 26.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.296 1.038 . . . . 0.0 108.284 175.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.9 p -59.92 -30.77 69.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -74.99 -37.04 61.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.048 0.386 . . . . 0.0 111.779 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -70.81 -51.5 26.37 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 122.726 0.41 . . . . 0.0 110.231 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 38.1 t -69.08 -43.03 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.138 0.575 . . . . 0.0 109.743 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.29 -29.48 57.41 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -73.79 -33.67 64.32 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 120.124 1.329 . . . . 0.0 109.839 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 399' ' ' VAL . . . . . 0.411 HG22 ' CD2' ' A' ' 556' ' ' LEU . 17.6 t -57.31 -57.06 11.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.272 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.558 2.8 p90 -76.49 -4.03 40.48 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 117.758 2.503 . . . . 0.0 117.758 175.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.37 -33.15 58.91 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.881 -0.512 . . . . 0.0 111.085 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -60.81 -14.86 24.4 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -84.51 -9.78 58.03 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.17 -151.71 15.35 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.354 0.525 . . . . 0.0 112.233 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -99.57 126.15 45.5 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.551 0.34 . . . . 0.0 110.961 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.02 165.47 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.86 -62.76 1.22 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -144.28 161.17 39.6 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -169.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.14 150.32 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.45 1.1 . . . . 0.0 109.162 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -157.47 132.42 8.76 Favored 'General case' 0 CA--C 1.527 0.096 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.8 m-85 -82.89 163.66 20.98 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -122.43 123.14 40.63 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 122.838 0.455 . . . . 0.0 111.959 -177.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.006 0.523 . . . . 0.0 111.254 169.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.9 p -77.91 -7.76 57.18 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.292 0.637 . . . . 0.0 112.432 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -132.13 159.47 72.04 Favored Pre-proline 0 CA--C 1.529 0.147 0 C-N-CA 124.131 0.973 . . . . 0.0 109.319 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -16.43 54.87 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.92 2.413 . . . . 0.0 111.013 177.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 173.5 101.16 0.14 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.25 158.55 39.01 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.428 0.691 . . . . 0.0 109.75 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.19 153.88 29.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.008 0.433 . . . . 0.0 110.985 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.3 ttm -107.39 151.19 25.84 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.024 0.929 . . . . 0.0 108.749 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.7 t -136.83 152.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 123.299 0.639 . . . . 0.0 111.599 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -132.12 128.93 39.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.2 mtp -152.53 171.11 18.62 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -170.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.445 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.92 125.65 26.61 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 169.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -73.31 -29.63 62.83 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -63.94 -83.65 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 -178.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -72.66 -36.48 67.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.72 -33.32 18.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 119.944 1.247 . . . . 0.0 114.151 -169.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 52.5 t -88.88 -24.49 6.0 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.13 1.332 . . . . 0.0 109.858 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -70.84 -50.83 31.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -65.11 -35.21 80.4 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.36 77.55 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.576 0.625 . . . . 0.0 110.552 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 72.6 mt -79.91 -9.1 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.088 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 26.0 m -98.85 -20.18 16.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.17 -29.52 2.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -169.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.06 -13.09 7.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.623 1.556 . . . . 0.0 113.56 -173.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.7 p-10 -71.62 100.79 2.36 Favored 'General case' 0 C--O 1.201 -1.46 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -167.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.3 m-80 76.65 22.04 1.21 Allowed 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 123.666 2.939 . . . . 0.0 113.207 -162.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -79.25 163.19 25.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.494 -0.754 . . . . 0.0 109.425 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.39 135.94 36.27 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.6 ttt -157.67 142.61 16.7 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 59.55 18.5 7.07 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 116.53 2.048 . . . . 0.0 116.53 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.31 11.38 85.39 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 -174.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -134.51 -162.86 1.3 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.439 1.496 . . . . 0.0 108.474 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -136.86 149.72 47.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.95 0.405 . . . . 0.0 111.023 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 13.9 ptm -127.45 83.59 2.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.116 0.966 . . . . 0.0 108.873 178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -55.92 127.96 32.83 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-O 115.759 -2.067 . . . . 0.0 112.21 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.43 2.0 t -128.54 152.66 36.98 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 113.48 -3.288 . . . . 0.0 116.51 169.208 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -160.3 167.44 27.49 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.375 1.47 . . . . 0.0 107.974 177.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.23 146.4 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.5 t -83.03 166.02 19.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.827 0.451 . . . . 0.0 111.253 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.16 12.48 7.12 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -85.33 151.85 57.1 Favored Pre-proline 0 N--CA 1.456 -0.151 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.05 -36.56 4.21 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.789 2.326 . . . . 0.0 112.506 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.89 158.78 7.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.764 0.425 . . . . 0.0 111.42 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -75.31 130.53 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.5 mmm -97.08 118.6 64.59 Favored Pre-proline 0 N--CA 1.454 -0.254 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.512 175.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.19 163.45 32.69 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.167 2.578 . . . . 0.0 109.772 175.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.52 -144.52 12.35 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -72.45 152.32 42.03 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.373 0.669 . . . . 0.0 109.83 -179.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 89.1 p -151.92 166.19 32.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.989 0.424 . . . . 0.0 111.439 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -84.63 -4.42 58.99 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.68 -177.69 51.35 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.7 mt -141.85 157.44 45.0 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.977 0.911 . . . . 0.0 108.996 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -75.37 -12.03 60.17 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.364 -0.21 . . . . 0.0 111.452 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -120.4 26.64 9.07 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.668 0.787 . . . . 0.0 110.122 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.92 -154.19 8.56 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -177.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 41.6 t -133.05 -26.11 1.74 Allowed 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.613 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 98.0 m -127.01 155.96 42.38 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.485 0.714 . . . . 0.0 110.338 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.4 p -75.93 -23.08 55.42 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -95.26 148.49 22.36 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -157.15 157.49 34.54 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.088 0.555 . . . . 0.0 109.901 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -134.35 153.19 52.03 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -128.01 2.67 5.9 Favored 'General case' 0 CA--C 1.527 0.091 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.3 p -66.07 -17.73 64.88 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.6 0.36 . . . . 0.0 111.762 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.05 2.07 14.83 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.405 0.682 . . . . 0.0 111.321 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 39.9 t -82.33 -7.85 59.63 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.962 0.505 . . . . 0.0 112.014 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' ARG . . . . . 0.406 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 49.7 ttt180 62.4 -7.96 0.12 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.126 1.37 . . . . 0.0 113.155 -177.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -65.56 -15.8 63.07 Favored 'General case' 0 C--O 1.231 0.093 0 O-C-N 121.685 -0.635 . . . . 0.0 112.581 -178.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -55.56 125.34 20.61 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -72.97 -33.77 66.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -169.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.376 57.1 m-85 -98.19 8.15 45.22 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 117.946 2.573 . . . . 0.0 117.946 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.7 t -76.16 -13.78 60.18 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -132.44 149.56 73.46 Favored Pre-proline 0 C--O 1.231 0.087 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -71.58 -23.87 22.7 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.28 2.653 . . . . 0.0 111.624 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.56 -25.34 53.95 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.133 0.424 . . . . 0.0 110.317 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -86.68 -48.29 8.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -65.18 -19.53 66.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.476 0.71 . . . . 0.0 112.765 -171.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.62 -29.22 62.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.243 0.474 . . . . 0.0 111.388 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -124.06 10.25 8.77 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -60.46 154.51 20.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.663 0.665 . . . . 0.0 112.719 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -155.34 138.71 15.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 47.2 mt -142.12 142.74 27.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 C-N-CA 123.449 0.7 . . . . 0.0 109.511 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -148.27 173.39 13.07 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 123.801 0.841 . . . . 0.0 110.336 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -58.73 153.9 39.21 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.296 0.638 . . . . 0.0 110.049 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.22 147.44 88.07 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 123.087 2.525 . . . . 0.0 110.267 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.4 t -152.67 174.49 13.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.388 0.675 . . . . 0.0 109.771 -174.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -83.68 -0.64 51.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -178.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -99.71 136.45 30.9 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 552' ' ' ALA . 4.6 mm? -121.14 156.23 32.79 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.805 0.842 . . . . 0.0 109.644 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -127.1 142.35 51.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -136.6 158.95 43.24 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.305 0.574 . . . . 0.0 111.257 -176.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -150.16 164.49 35.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.403 -2.814 . . . . 0.0 103.403 -177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 34.0 m120 58.53 56.79 4.11 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.949 0.5 . . . . 0.0 111.104 -172.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -122.02 151.94 59.06 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.724 0.41 . . . . 0.0 111.174 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.57 154.26 37.45 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.467 2.778 . . . . 0.0 112.118 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.78 -16.55 63.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.98 0.512 . . . . 0.0 111.675 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -122.83 27.71 7.6 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 123.701 0.8 . . . . 0.0 110.968 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.8 p -63.64 -17.01 19.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.54 -177.91 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -164.902 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 22.7 pt-20 -21.34 -41.77 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.794 1.638 . . . . 0.0 115.215 -169.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.6 -47.2 82.81 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 172.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -86.3 -27.01 24.62 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 121.709 2.049 . . . . 0.0 106.631 -173.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -67.12 -36.26 81.52 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -76.84 -38.65 53.38 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -73.58 -28.66 61.96 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.398 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.66 -44.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 O-C-N 121.966 -0.459 . . . . 0.0 110.969 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 31.2 p -69.12 -25.44 64.4 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.183 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.96 -42.46 85.16 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -70.41 -18.3 63.02 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 70.8 mt -96.07 -6.01 39.62 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.653 0.381 . . . . 0.0 111.415 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.59 -11.87 3.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.875 0.75 . . . . 0.0 113.769 177.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 24.1 m -77.79 159.37 4.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 118.194 0.997 . . . . 0.0 110.45 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -68.9 153.68 43.36 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.113 0.482 . . . . 0.0 111.627 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -76.08 157.03 83.76 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.48 0.712 . . . . 0.0 110.692 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.26 160.09 51.2 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.343 2.696 . . . . 0.0 111.015 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -95.25 -15.75 22.98 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.1 t -154.22 159.99 41.61 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 122.793 0.437 . . . . 0.0 110.313 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.29 150.08 12.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -145.6 141.06 27.83 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 124.0 0.92 . . . . 0.0 109.071 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 25.0 t -139.9 141.46 34.12 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 C-N-CA 123.524 0.729 . . . . 0.0 110.023 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.67 167.23 29.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 -177.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 36.7 t -89.76 170.72 10.19 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.654 0.782 . . . . 0.0 110.763 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 92.27 -178.07 39.9 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 123.751 0.691 . . . . 0.0 112.048 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 41.0 mttm 62.53 -12.08 0.07 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.083 1.753 . . . . 0.0 113.698 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 44.5 t -165.6 162.02 18.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.451 0.701 . . . . 0.0 110.466 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -116.95 -5.78 11.46 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.376 0.67 . . . . 0.0 110.104 174.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -91.98 -31.32 15.66 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.747 0.819 . . . . 0.0 112.275 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.7 p -159.11 168.92 25.4 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 121.089 0.471 . . . . 0.0 111.563 -171.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 32.9 t -89.5 170.93 10.09 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.847 0.859 . . . . 0.0 110.97 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.5 t -148.65 159.87 43.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.245 1.018 . . . . 0.0 109.186 178.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.71 -171.79 44.42 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.001 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 159.8 27.05 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.813 0.845 . . . . 0.0 110.441 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.0 mt -140.87 159.22 42.68 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.675 1.19 . . . . 0.0 108.859 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -150.32 148.74 29.2 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 122.102 -0.374 . . . . 0.0 111.745 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -126.72 171.36 11.25 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.106 1.362 . . . . 0.0 112.075 178.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -74.59 -10.41 59.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.59 0.356 . . . . 0.0 110.567 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.2 t -157.66 157.13 32.99 Favored 'General case' 0 C--O 1.231 0.123 0 O-C-N 121.698 -0.626 . . . . 0.0 110.444 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -75.04 -19.69 59.91 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.019 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.1 m -80.84 -29.45 35.86 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 118.188 0.449 . . . . 0.0 110.181 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.99 -36.47 72.49 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 121.41 0.624 . . . . 0.0 111.219 171.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 552' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 500' ' ' LEU . . . -72.22 -27.01 62.26 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.663 177.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.2 tp -79.82 -45.22 19.13 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.596 0.358 . . . . 0.0 111.539 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.5 -33.46 75.97 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -73.81 -28.15 61.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 175.304 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 556' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' A' ' 399' ' ' VAL . 1.8 tt -70.38 -35.18 73.34 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 171.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -57.36 -49.45 72.74 Favored Glycine 0 C--N 1.335 0.519 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.305 35.1 m-85 -84.07 -11.78 56.16 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.395 2.739 . . . . 0.0 118.395 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.15 -20.68 14.07 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.823 0.738 . . . . 0.0 112.859 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -70.64 139.39 51.31 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 119.315 0.962 . . . . 0.0 109.532 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.2 t60 55.96 17.12 2.43 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.031 1.332 . . . . 0.0 113.444 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 32.7 t80 -72.68 139.4 47.25 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -69.7 140.76 53.57 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.958 -0.464 . . . . 0.0 112.193 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.4 mtm -83.57 152.66 24.74 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.921 0.391 . . . . 0.0 111.362 175.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -74.45 161.28 29.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -149.17 122.38 4.51 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 122.2 0.2 . . . . 0.0 110.636 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.27 -24.4 7.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.567 2.845 . . . . 0.0 112.623 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -156.1 -1.17 0.13 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -70.14 153.05 51.7 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.49 -26.67 16.62 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.351 2.701 . . . . 0.0 111.309 -178.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -155.89 151.82 22.63 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 178.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.82 159.17 48.94 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.381 2.721 . . . . 0.0 111.196 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -130.01 142.32 50.64 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 102.731 -3.062 . . . . 0.0 102.731 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.263 0.6 OUTLIER -76.55 141.46 41.17 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 -176.271 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.41 138.15 32.99 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.3 1.44 . . . . 0.0 107.658 173.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 150.08 51.71 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 118.091 0.405 . . . . 0.0 110.308 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.25 162.79 40.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.173 0.511 . . . . 0.0 111.247 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.6 p -158.57 167.6 29.16 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.823 0.849 . . . . 0.0 110.378 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -56.0 122.91 12.69 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.454 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 35.1 t -80.12 153.38 28.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -169.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 t -119.05 12.43 12.73 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.16 0.984 . . . . 0.0 113.434 169.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.03 20.19 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.138 0.975 . . . . 0.0 111.88 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -92.62 -3.49 54.88 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.571 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -153.9 171.49 18.9 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.75 0.82 . . . . 0.0 110.436 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.63 24.91 0.97 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.471 0.708 . . . . 0.0 110.198 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.604 -1.188 . . . . 0.0 110.439 -176.629 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.479 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 O4'-C1'-N19 112.188 3.988 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C5'-C4'-C3' 110.477 -3.349 . 0.385 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 2 C5'-C4'-C3' 105.812 -6.459 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.645 1 C5'-C4'-C3' 108.817 -4.455 . 0.01 2u . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 1 O4'-C1'-N19 113.994 5.794 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C3'-C2'-C1' 104.861 3.735 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . 0.406 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C5'-C4'-C3' 111.22 -2.853 . 0.232 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 C3'-C2'-C1' 104.378 3.198 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.454 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 O4'-C1'-N19 111.56 3.36 . 0.243 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.73 1 C5'-C4'-C3' 108.732 -4.512 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.284 16.6 t80 . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.9 -174.82 45.43 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.34 165.29 5.83 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 124.683 3.589 . . . . 0.0 112.724 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -150.17 155.71 40.27 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.016 0.526 . . . . 0.0 110.569 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.83 161.15 29.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -76.61 -8.83 58.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.771 0.428 . . . . 0.0 110.272 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -157.29 147.77 16.03 Favored Pre-proline 0 CA--C 1.527 0.086 0 O-C-N 121.7 -0.625 . . . . 0.0 110.74 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.91 -17.21 46.57 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.239 2.626 . . . . 0.0 110.539 173.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.1 151.49 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -141.38 155.12 45.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.676 1.19 . . . . 0.0 108.338 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 43.9 tpp -136.63 137.52 40.19 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.343 0.257 . . . . 0.0 110.827 -176.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -131.69 150.91 34.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.54 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 9.9 m-85 -138.04 175.69 9.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 -178.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 12.34 77.73 Favored Glycine 0 CA--C 1.528 0.892 0 N-CA-C 112.014 -0.434 . . . . 0.0 112.014 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.22 25.95 0.57 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.343 0.657 . . . . 0.0 111.655 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -64.86 -40.21 94.79 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -176.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 388' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.1 pm0 -67.94 147.85 51.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.0 0.429 . . . . 0.0 110.582 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 49.9 m -70.54 -8.47 51.64 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -72.95 -17.19 61.5 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.124 0.42 . . . . 0.0 111.42 178.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 66.3 mmm -85.18 148.14 26.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.088 0.403 . . . . 0.0 110.588 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.38 155.52 22.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.9 p -61.29 -30.56 70.56 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -72.45 -39.46 67.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.763 0.316 . . . . 0.0 110.559 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -76.06 -41.18 51.48 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 t -71.06 -43.65 75.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -75.1 -30.01 60.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 0.409 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.4 p30 -78.23 -28.31 47.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.018 1.281 . . . . 0.0 110.234 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 399' ' ' VAL . . . . . 0.49 HG22 HD12 ' A' ' 556' ' ' LEU . 2.4 t -59.53 -57.02 13.43 Favored 'Isoleucine or valine' 0 C--N 1.341 0.222 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -178.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.551 1.6 p90 -76.65 -5.71 49.03 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 401' ' ' CYS . . . . . 0.409 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 48.7 t -71.37 -32.27 68.29 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 117.973 0.351 . . . . 0.0 110.609 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -62.59 -14.99 48.97 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 120.321 -0.551 . . . . 0.0 111.279 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -90.5 -2.16 57.91 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 117.811 2.523 . . . . 0.0 117.811 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.0 -170.16 40.59 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.748 0.703 . . . . 0.0 113.054 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -83.07 132.62 35.11 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.54 -0.388 . . . . 0.0 110.797 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.94 165.53 8.82 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.096 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -177.035 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -122.49 -68.83 0.86 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.423 0.289 . . . . 0.0 111.522 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -154.54 174.44 14.93 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.219 0.463 . . . . 0.0 112.091 -177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.47 149.94 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 C-N-CA 124.426 1.09 . . . . 0.0 109.531 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -155.27 130.21 9.38 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.854 0.461 . . . . 0.0 111.314 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.279 3.7 m-85 -80.98 152.09 28.15 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 178.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 412' ' ' MET . . . . . 0.461 ' HE3' ' HG3' ' A' ' 420' ' ' MET . 34.7 mmt -73.5 134.17 43.8 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-O 121.111 0.481 . . . . 0.0 111.808 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -79.21 -33.96 43.29 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.898 0.879 . . . . 0.0 111.974 178.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 70.7 m -102.05 -17.91 15.85 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -174.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -91.74 150.27 40.59 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 118.445 0.566 . . . . 0.0 110.562 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.18 -12.81 23.42 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.668 2.912 . . . . 0.0 112.432 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.82 81.42 0.06 OUTLIER Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.334 -0.706 . . . . 0.0 111.334 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.69 161.34 39.85 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.062 0.545 . . . . 0.0 109.87 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.95 149.28 19.54 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 420' ' ' MET . . . . . 0.461 ' HG3' ' HE3' ' A' ' 412' ' ' MET . 78.5 mtp -93.6 151.51 19.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.973 0.909 . . . . 0.0 109.588 172.152 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.0 t -143.9 154.24 15.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -138.71 133.79 32.72 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 28.1 mtm -153.24 175.59 12.9 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 124.238 1.015 . . . . 0.0 109.5 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 424' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.45 123.57 19.56 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 172.028 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -72.43 -32.41 66.3 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -167.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.83 -89.39 0.01 OUTLIER Glycine 0 C--N 1.339 0.705 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -71.68 -29.12 64.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.47 -35.15 18.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.765 -172.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 55.8 t -89.3 -26.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 118.319 -1.352 . . . . 0.0 109.447 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -68.56 -49.27 60.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.064 175.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -70.41 -31.37 68.54 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.66 78.31 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.876 0.762 . . . . 0.0 110.213 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.04 -15.59 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.121 0.569 . . . . 0.0 110.882 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.7 m -91.01 -20.66 21.86 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -123.46 -29.55 3.77 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 -169.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.0 mt -134.42 -5.53 2.59 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -171.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 437' ' ' ASN . . . . . 0.64 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 34.3 p-10 -71.65 100.99 2.42 Favored 'General case' 0 C--O 1.204 -1.341 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -169.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 438' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.9 m-80 77.21 22.06 1.02 Allowed 'General case' 0 N--CA 1.483 1.216 0 O-C-N 117.713 -3.117 . . . . 0.0 113.019 -160.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -83.08 156.96 23.04 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.946 -1.096 . . . . 0.0 109.752 167.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.252 21.8 m-85 -74.71 142.59 44.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 28.2 ttt -161.51 140.16 9.66 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.433 0.693 . . . . 0.0 109.901 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.386 47.7 m-85 56.83 27.21 12.57 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 117.77 2.508 . . . . 0.0 117.77 -179.476 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.7 7.56 88.12 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -133.71 -163.49 1.37 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.953 1.301 . . . . 0.0 108.211 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -138.88 146.33 41.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.29 107.31 10.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 447' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 3.6 m-20 -69.35 133.92 48.42 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 115.653 -2.118 . . . . 0.0 111.813 -171.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 448' ' ' VAL . . . . . 0.64 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.465 2.0 t -125.11 151.18 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 113.191 -3.404 . . . . 0.0 115.132 168.44 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.7 t -161.48 165.98 27.85 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.807 1.243 . . . . 0.0 108.269 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.1 p -70.98 148.32 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.9 t -85.52 159.79 19.82 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.963 0.505 . . . . 0.0 110.969 177.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.458 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 64.7 pttt -105.13 0.02 27.04 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 121.948 0.099 . . . . 0.0 111.144 177.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -82.16 149.68 62.9 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.46 0.704 . . . . 0.0 110.507 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.02 -34.27 2.31 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.225 2.617 . . . . 0.0 112.148 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.11 158.75 12.43 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.366 0.666 . . . . 0.0 110.452 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.7 mt -85.09 135.86 23.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 174.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 60.4 mmm -98.8 156.69 35.3 Favored Pre-proline 0 N--CA 1.454 -0.258 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.24 118.69 5.11 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.883 2.388 . . . . 0.0 110.418 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -84.77 142.8 20.3 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 -176.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -77.74 125.6 29.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.6 p -77.79 153.39 32.89 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.864 0.364 . . . . 0.0 111.194 -176.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -139.83 -5.82 1.32 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.87 118.32 0.24 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.278 0.942 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.3 mt -77.36 160.22 28.94 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -69.3 -15.42 63.34 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 122.126 -0.359 . . . . 0.0 111.671 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -120.47 24.9 10.11 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.29 0.636 . . . . 0.0 110.186 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.94 -160.31 12.24 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 121.698 -0.626 . . . . 0.0 111.698 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 71.9 m -132.97 -5.54 3.11 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 95.1 m -127.03 155.67 42.86 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.162 0.585 . . . . 0.0 110.778 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.1 m -121.23 4.34 10.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.165 0.586 . . . . 0.0 110.34 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -144.82 147.77 33.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.517 1.127 . . . . 0.0 112.619 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -154.15 154.25 33.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.189 0.449 . . . . 0.0 111.374 -177.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -128.41 139.83 52.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.216 1.006 . . . . 0.0 113.387 -177.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -126.59 5.46 6.81 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 40.9 t -64.26 -27.03 68.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.713 0.405 . . . . 0.0 111.663 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -100.85 -1.36 34.92 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 122.918 0.487 . . . . 0.0 111.601 178.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.9 t -81.56 149.57 28.59 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.125 -0.36 . . . . 0.0 111.457 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -87.5 -4.94 58.99 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.215 0.606 . . . . 0.0 111.208 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -63.34 -19.15 64.37 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -62.18 109.15 1.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.199 0.6 . . . . 0.0 109.606 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -73.99 -29.27 61.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.305 69.7 m-85 -97.98 15.14 24.95 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.3 t -74.22 -14.76 60.98 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -131.06 148.37 70.0 Favored Pre-proline 0 C--O 1.233 0.214 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -177.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -72.27 -26.25 17.77 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.278 2.652 . . . . 0.0 112.063 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -79.09 -27.93 43.02 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.495 0.589 . . . . 0.0 110.007 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -77.28 -43.97 31.39 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 175.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.48 -19.24 63.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.69 -18.1 42.13 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 -1.48 8.26 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.28 162.05 15.5 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.257 0.551 . . . . 0.0 111.673 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' ARG . . . . . 0.438 ' NE ' " H2'" ' C' ' 4' ' ' ' C' . 0.0 OUTLIER -146.16 140.98 27.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.562 0.745 . . . . 0.0 109.75 178.824 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 33.5 mm -143.8 138.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -149.55 173.38 13.68 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.512 0.725 . . . . 0.0 110.361 -177.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -58.74 155.06 32.7 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -64.54 151.79 84.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.839 2.359 . . . . 0.0 109.351 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -154.51 169.17 24.43 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.793 0.437 . . . . 0.0 110.042 -174.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -83.77 -8.03 59.33 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.92 145.18 8.6 Favored 'Isoleucine or valine' 0 C--N 1.339 0.112 0 C-N-CA 123.34 0.656 . . . . 0.0 111.887 173.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.0 tp -138.05 153.16 49.36 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -126.95 148.38 50.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.678 0.791 . . . . 0.0 109.103 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -144.53 160.77 40.58 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.555 0.693 . . . . 0.0 109.746 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -152.75 164.9 36.9 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 104.01 -2.589 . . . . 0.0 104.01 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 59.11 57.6 3.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.919 0.488 . . . . 0.0 111.971 -173.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.44 153.52 53.85 Favored Pre-proline 0 CA--C 1.532 0.268 0 C-N-CA 123.042 0.537 . . . . 0.0 110.454 177.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.07 159.19 54.11 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.373 2.049 . . . . 0.0 110.229 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.46 -16.53 63.93 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.603 0.361 . . . . 0.0 111.498 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -109.27 19.04 19.86 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.248 0.619 . . . . 0.0 111.449 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 3.8 p -63.26 -18.91 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.079 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -175.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.607 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.86 -177.38 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 117.852 -1.07 . . . . 0.0 113.772 -165.541 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 511' ' ' GLU . . . . . 0.607 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -25.92 -37.9 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -169.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.2 mt-10 -58.21 -48.08 81.48 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 117.142 -1.409 . . . . 0.0 114.451 171.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -86.63 -27.14 24.0 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 122.529 2.422 . . . . 0.0 106.686 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -65.09 -38.59 91.2 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 176.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -74.88 -37.84 62.04 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -80.43 -22.05 41.57 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.542 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 50.3 mt -76.38 -43.89 35.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.418 0.554 . . . . 0.0 110.671 177.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 29.3 p -69.28 -33.92 73.95 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.729 0.695 . . . . 0.0 110.307 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -72.46 -26.2 61.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.2 tp10 -75.27 -26.71 58.99 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.284 0.234 . . . . 0.0 110.626 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -95.96 -2.9 46.11 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.231 0.613 . . . . 0.0 111.738 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 77.06 -1.19 64.45 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 123.416 0.532 . . . . 0.0 112.832 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.92 151.6 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 CA-C-N 117.995 0.897 . . . . 0.0 111.74 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -67.15 150.18 49.49 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.017 0.437 . . . . 0.0 110.38 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -76.98 152.61 82.54 Favored Pre-proline 0 CA--C 1.531 0.221 0 C-N-CA 123.012 0.525 . . . . 0.0 110.716 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.93 156.85 61.88 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.533 2.822 . . . . 0.0 110.631 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -89.71 -18.09 27.06 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 37.8 t -154.64 160.64 41.55 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 120.494 0.188 . . . . 0.0 110.842 176.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.81 146.54 9.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -177.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -147.23 141.13 25.86 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.051 0.941 . . . . 0.0 109.068 172.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.77 151.86 28.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -155.81 177.24 11.62 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 38.0 t -141.95 165.54 27.17 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.566 0.746 . . . . 0.0 109.859 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 123.96 -19.46 7.35 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.679 0.657 . . . . 0.0 111.636 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -80.24 -23.92 40.53 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.645 0.722 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 47.6 t -164.86 157.46 16.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.764 0.826 . . . . 0.0 109.487 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -97.0 -4.71 39.29 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.431 0.292 . . . . 0.0 110.257 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -78.13 -36.53 47.75 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.9 p -161.11 167.69 25.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.436 0.636 . . . . 0.0 112.325 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 48.4 t -85.56 164.99 17.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.223 1.009 . . . . 0.0 110.738 176.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 93.6 p -150.21 162.44 40.47 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.217 1.007 . . . . 0.0 108.414 177.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.94 -169.01 42.15 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.663 -178.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -121.12 160.23 24.15 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.978 0.911 . . . . 0.0 110.423 -177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.6 mt -142.12 163.97 31.43 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.14 1.376 . . . . 0.0 109.047 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -153.69 147.28 25.1 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.331 -0.231 . . . . 0.0 111.33 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.4 m-90 -126.15 172.53 9.95 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.164 1.386 . . . . 0.0 112.33 177.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -73.5 -7.78 53.22 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 39.9 t -159.64 162.05 35.11 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 122.963 0.505 . . . . 0.0 110.674 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -69.29 -30.94 69.14 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.346 -0.221 . . . . 0.0 110.55 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.6 m -75.65 -23.36 56.3 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 122.087 0.155 . . . . 0.0 110.784 178.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -74.09 -36.36 64.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.016 0.436 . . . . 0.0 111.66 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.04 -26.39 56.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.292 176.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.9 tp -78.46 -37.55 43.22 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.367 0.267 . . . . 0.0 111.421 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -72.68 -38.25 67.64 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.16 -27.14 63.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 175.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 556' ' ' LEU . . . . . 0.541 HD13 ' C ' ' A' ' 556' ' ' LEU . 1.1 tm? -66.94 -41.73 86.46 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.17 -31.63 79.64 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 119.691 -0.505 . . . . 0.0 112.307 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.273 6.2 m-85 -94.52 -10.0 33.57 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 177.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 89.6 mt -119.86 -8.94 9.78 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -70.48 139.15 51.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.516 1.053 . . . . 0.0 109.289 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.1 t60 58.75 17.83 5.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.997 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 29.2 t80 -68.89 138.34 54.59 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -74.0 136.6 43.19 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.782 -0.574 . . . . 0.0 112.29 -174.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.0 mtm -83.64 152.69 24.66 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.026 0.53 . . . . 0.0 111.79 175.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.3 158.32 29.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 170.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -152.15 118.42 3.11 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.8 -17.82 17.54 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.402 2.735 . . . . 0.0 114.163 -172.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -156.61 -11.72 0.1 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.21 0.913 . . . . 0.0 113.375 -176.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -70.95 157.6 53.59 Favored Glycine 0 CA--C 1.53 0.969 0 CA-C-N 118.799 0.727 . . . . 0.0 111.483 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.0 -20.65 25.2 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.91 3.074 . . . . 0.0 111.993 -177.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -154.54 153.15 27.44 Favored Pre-proline 0 N--CA 1.454 -0.234 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.39 167.23 27.82 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.589 2.859 . . . . 0.0 110.71 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -129.96 142.38 50.65 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 102.178 -3.267 . . . . 0.0 102.178 175.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.285 0.6 OUTLIER -82.42 138.48 34.41 Favored 'General case' 0 C--O 1.23 0.062 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -173.79 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 575' ' ' LEU . . . . . 0.406 HD13 ' C ' ' A' ' 575' ' ' LEU . 1.3 tm? -81.17 137.52 35.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.279 1.431 . . . . 0.0 107.694 172.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.89 147.47 52.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.46 161.1 40.08 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.946 0.403 . . . . 0.0 111.083 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.73 173.68 12.57 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.8 0.84 . . . . 0.0 110.33 -177.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -53.98 124.5 15.69 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' SER . . . . . 0.419 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 36.6 t -77.02 153.4 34.5 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 -171.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.261 1.0 OUTLIER -123.62 9.07 8.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.719 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.96 163.87 16.29 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.494 0.718 . . . . 0.0 110.704 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -82.83 0.58 43.31 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.41 165.37 1.4 Allowed 'General case' 0 C--O 1.23 0.029 0 C-N-CA 124.536 1.134 . . . . 0.0 110.196 175.295 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -84.29 -6.68 59.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.394 -1.289 . . . . 0.0 111.294 -179.483 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ' A' . . . . . 0.54 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.671 0 O4'-C1'-N19 112.113 3.913 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ' C' . . . . . 0.458 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 C5'-C4'-C3' 110.415 -3.39 . 0.353 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ' A' . . . . . 0.512 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.997 0 C3'-C2'-C1' 104.837 3.708 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.312 0 C3'-C2'-C1' 104.838 3.709 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' ' A' . . . . . 0.615 ' C8 ' H5'' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 1 O4'-C1'-N19 112.491 4.291 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 1' ' ' ' A' . . . . . 0.479 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 C3'-C2'-C1' 104.729 3.588 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.793 0 C5'-C4'-C3' 111.047 -2.968 . 0.072 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C3'-C2'-C1' 104.846 3.718 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 4' ' ' ' C' . . . . . 0.438 " H2'" ' NE ' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.419 -2.799 0 O4'-C1'-N19 110.758 2.558 . 0.226 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.576 1 C5'-C4'-C3' 109.284 -4.144 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo . . . . . 0 N--CA 1.455 -0.77 0 N-CA-C 110.978 -0.432 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -145.4 157.94 43.93 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.917 0.487 . . . . 0.0 110.851 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.75 156.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -76.37 0.88 17.93 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -157.43 146.72 15.0 Favored Pre-proline 0 CA--C 1.53 0.18 0 C-N-CA 122.741 0.417 . . . . 0.0 110.699 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.74 -10.7 29.85 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 123.239 2.626 . . . . 0.0 111.073 173.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.98 155.77 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.617 0.767 . . . . 0.0 112.386 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -137.98 154.4 49.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.333 1.053 . . . . 0.0 109.309 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 82.3 mmm -126.01 142.41 51.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 123.399 0.68 . . . . 0.0 111.836 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -136.24 148.69 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -140.74 174.28 10.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.55 10.11 82.24 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 45.3 mt -80.45 25.96 0.39 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.531 0.732 . . . . 0.0 112.239 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.51 -39.78 94.42 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -67.58 150.62 48.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.122 0.487 . . . . 0.0 111.217 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 87.6 p -69.06 -8.75 48.04 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -77.27 -17.06 58.69 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 117.92 0.327 . . . . 0.0 111.3 -176.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 65.4 mmm -88.29 145.43 25.85 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.943 0.338 . . . . 0.0 110.422 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -160.92 158.32 27.98 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.8 p -60.28 -30.93 69.78 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -174.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -70.4 -41.54 72.85 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 177.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.96 -42.47 48.34 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.52 -174.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -69.37 -43.01 81.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -176.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.28 -30.81 57.94 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.025 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -76.97 -30.77 56.12 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.914 1.234 . . . . 0.0 110.101 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.84 -55.76 21.84 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.559 1.3 p90 -76.51 -4.72 44.19 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 117.679 2.474 . . . . 0.0 117.679 173.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.1 t -72.74 -32.36 65.62 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 122.144 -0.347 . . . . 0.0 110.414 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.39 -17.19 52.97 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.49 177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -88.5 -4.53 58.59 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.99 176.03 33.65 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-N 118.605 0.639 . . . . 0.0 112.431 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.93 134.22 49.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 122.539 -0.389 . . . . 0.0 111.698 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.02 165.47 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 124.614 1.166 . . . . 0.0 113.65 -179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -121.49 -65.36 1.14 Allowed 'General case' 0 N--CA 1.457 -0.077 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.183 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -154.47 167.02 31.44 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.1 p -138.64 150.24 23.91 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 C-N-CA 124.031 0.933 . . . . 0.0 110.136 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -151.41 125.4 9.2 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.066 0.547 . . . . 0.0 110.988 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -85.3 157.65 20.51 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.3 ptp -136.39 135.64 38.94 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 121.948 0.88 . . . . 0.0 112.487 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 413' ' ' LYS . 11.8 ptmm? -79.13 -5.7 54.77 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 126.061 1.744 . . . . 0.0 112.769 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.8 t -77.76 -4.12 44.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.918 0.326 . . . . 0.0 111.823 -171.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -141.74 157.36 65.02 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 124.159 0.983 . . . . 0.0 109.255 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.42 -11.91 33.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.177 2.585 . . . . 0.0 112.037 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.86 93.3 0.09 OUTLIER Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 175.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.5 162.78 39.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.788 0.435 . . . . 0.0 110.708 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.33 170.87 21.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.963 0.505 . . . . 0.0 110.243 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 21.6 ptm -131.97 152.23 51.24 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.695 0.798 . . . . 0.0 109.181 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.4 t -138.55 150.49 24.05 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.208 0 C-N-CA 123.184 0.594 . . . . 0.0 112.236 -173.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -129.06 131.09 47.27 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 46.0 mtp -152.87 174.89 13.52 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.588 0.755 . . . . 0.0 109.439 -170.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.468 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.66 115.5 7.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.5 p30 -72.24 -32.6 66.85 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -167.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.94 -86.47 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -74.65 -27.08 60.27 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 117.125 2.268 . . . . 0.0 117.125 -176.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.84 -35.2 17.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.074 -174.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.8 t -86.41 -27.21 6.07 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 CA-C-N 119.776 1.171 . . . . 0.0 108.818 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -66.19 -50.79 62.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.036 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -70.35 -30.56 67.55 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.54 -33.92 76.75 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.65 0.659 . . . . 0.0 110.168 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 52.5 mt -80.1 -16.84 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.472 0.709 . . . . 0.0 110.782 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -90.22 -19.71 23.85 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -126.14 -28.53 3.13 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 91.2 mt -134.38 -8.35 2.56 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.54 1.518 . . . . 0.0 114.911 -170.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.06 2.45 Favored 'General case' 0 C--O 1.202 -1.418 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.4 m-80 79.4 20.75 0.66 Allowed 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 124.281 3.219 . . . . 0.0 114.058 -161.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -75.71 162.99 27.75 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.065 -1.022 . . . . 0.0 110.641 167.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -80.0 140.16 36.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 175.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.1 ttt -160.41 138.4 9.84 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.831 0.852 . . . . 0.0 109.957 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 52.6 m-85 56.99 24.21 9.22 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.59 9.46 86.4 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.661 -0.575 . . . . 0.0 111.661 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -135.18 -168.91 2.27 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.905 1.282 . . . . 0.0 108.716 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -122.0 151.85 40.37 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.653 0.263 . . . . 0.0 111.221 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 10.5 ptm -127.25 75.74 1.61 Allowed 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 124.873 1.269 . . . . 0.0 109.203 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -53.35 128.1 27.19 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 115.482 -2.199 . . . . 0.0 112.266 -173.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.428 2.0 t -126.64 150.87 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.439 -3.304 . . . . 0.0 115.76 168.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -164.74 170.27 15.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.645 1.178 . . . . 0.0 109.71 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.0 t -74.53 145.54 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 45.4 t -86.15 170.04 12.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.55 0.74 . . . . 0.0 111.414 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -115.98 0.72 13.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.554 0.342 . . . . 0.0 110.479 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -76.24 150.15 82.61 Favored Pre-proline 0 CA--C 1.53 0.183 0 C-N-CA 123.685 0.794 . . . . 0.0 110.94 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.91 -38.48 1.22 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.953 2.435 . . . . 0.0 111.522 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.93 159.54 7.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.719 0.808 . . . . 0.0 110.213 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 50.8 mt -78.36 143.94 11.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.077 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 82.1 mtp -120.22 130.37 24.88 Favored Pre-proline 0 CA--C 1.528 0.112 0 CA-C-N 117.622 0.192 . . . . 0.0 111.498 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.34 170.09 20.07 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 124.033 3.155 . . . . 0.0 109.612 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.17 -123.91 1.78 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -72.42 157.89 36.79 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.035 0.534 . . . . 0.0 109.738 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 91.9 p -151.93 174.08 14.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.834 0.454 . . . . 0.0 110.273 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.97 3.25 4.05 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.82 -175.05 54.65 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -176.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 78.7 mt -143.94 166.46 24.9 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.332 1.053 . . . . 0.0 109.328 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.81 -30.42 68.98 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 122.304 -0.248 . . . . 0.0 110.821 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -120.46 13.7 11.84 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -147.41 163.12 28.73 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 -178.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.8 t -86.57 -32.34 20.71 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.66 0.384 . . . . 0.0 111.703 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.5 m -127.1 155.63 43.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.3 0.64 . . . . 0.0 111.296 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.9 p -79.17 3.31 18.09 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.7 0.4 . . . . 0.0 110.778 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -136.04 149.71 48.89 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -152.99 151.83 30.72 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.39 0.276 . . . . 0.0 110.597 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -121.58 137.83 54.57 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -130.89 4.34 4.5 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 94.7 p -66.76 -16.09 64.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.104 0.562 . . . . 0.0 111.997 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -114.08 1.29 14.57 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.117 0.567 . . . . 0.0 111.322 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.5 t -77.96 149.0 34.2 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.785 0.434 . . . . 0.0 111.483 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 478' ' ' ARG . 12.6 ttp180 -81.69 -8.02 59.66 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.737 0.415 . . . . 0.0 110.87 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . 0.452 HD21 ' CD2' ' A' ' 561' ' ' HIS . 6.5 m-20 -62.38 -21.58 65.46 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 122.386 0.274 . . . . 0.0 111.695 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -61.91 112.77 2.45 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -30.05 59.94 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.286 66.6 m-85 -97.98 11.94 35.84 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -74.53 -13.83 60.73 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -134.58 149.27 70.45 Favored Pre-proline 0 C--N 1.338 0.102 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.78 -24.73 21.08 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 123.211 2.607 . . . . 0.0 111.797 -177.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -76.84 -16.78 59.33 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.232 0.469 . . . . 0.0 110.584 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 63.1 mm-40 -92.53 -45.71 7.98 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 173.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.13 -18.69 61.6 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.798 0.439 . . . . 0.0 112.177 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.12 -22.79 44.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -124.09 -0.66 8.34 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -61.4 156.8 18.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.377 0.535 . . . . 0.0 111.143 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -150.85 139.75 20.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.4 mm -140.61 138.18 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.725 0.81 . . . . 0.0 109.293 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -150.21 173.37 14.01 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.625 0.77 . . . . 0.0 110.052 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -60.51 152.86 63.91 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 122.926 0.49 . . . . 0.0 109.908 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.61 159.34 51.38 Favored 'Trans proline' 0 N--CA 1.449 -1.124 0 C-N-CA 123.209 2.606 . . . . 0.0 110.352 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 93.9 p -156.59 177.52 11.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -83.75 -2.67 56.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.03 143.41 11.26 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 123.756 0.822 . . . . 0.0 112.376 175.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.32 149.61 47.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -120.41 151.39 39.36 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.517 0.727 . . . . 0.0 109.199 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -144.0 159.32 42.8 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.41 0.624 . . . . 0.0 112.018 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -149.17 167.76 25.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 102.99 -2.967 . . . . 0.0 102.99 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 56.68 57.49 4.74 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 122.226 -0.296 . . . . 0.0 111.182 -174.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -128.91 152.07 78.5 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.859 0.464 . . . . 0.0 110.597 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.78 154.51 31.48 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.515 2.81 . . . . 0.0 113.132 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.4 -16.48 63.93 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.494 0.718 . . . . 0.0 111.66 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -122.95 24.75 8.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.441 0.696 . . . . 0.0 110.835 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.03 -9.56 10.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -175.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.73 -177.32 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -165.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -28.64 -35.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.8 mt-10 -58.87 -46.3 88.14 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 116.915 -1.517 . . . . 0.0 114.553 170.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -87.66 -27.6 22.36 Favored 'General case' 0 C--N 1.354 0.792 0 CA-C-N 122.826 2.557 . . . . 0.0 106.861 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -66.65 -32.45 73.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.65 -46.26 39.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -76.44 -24.4 53.92 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.626 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.6 mt -74.91 -44.38 45.04 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 118.588 0.631 . . . . 0.0 110.203 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 86.4 m -66.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.53 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -69.54 -24.02 63.66 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -77.47 -30.89 53.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.266 0.227 . . . . 0.0 110.668 175.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 94.0 mt -86.17 -3.66 59.01 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.028 0.531 . . . . 0.0 111.141 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.04 -3.11 62.59 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 123.35 0.5 . . . . 0.0 112.377 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.8 t -77.36 148.47 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 CA-C-N 117.696 0.748 . . . . 0.0 111.825 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.94 133.97 51.99 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -75.37 152.67 85.82 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.727 0.411 . . . . 0.0 110.03 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -65.06 153.18 79.53 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.335 2.69 . . . . 0.0 111.579 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -83.88 -14.75 50.35 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 33.5 t -152.36 153.8 34.35 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 122.478 0.311 . . . . 0.0 110.321 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 60.9 t -145.81 145.94 19.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.44 0.696 . . . . 0.0 110.958 -175.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -146.45 145.23 30.15 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.645 0.778 . . . . 0.0 109.461 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 10.7 t -143.52 144.21 23.62 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.72 -173.08 4.44 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.9 p -139.05 -179.24 5.73 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.95 0.9 . . . . 0.0 110.157 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.37 -9.62 67.14 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 123.74 0.686 . . . . 0.0 112.232 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -88.51 -26.26 22.13 Favored 'General case' 0 C--N 1.338 0.109 0 CA-C-N 117.816 0.808 . . . . 0.0 110.281 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.4 t -165.62 152.66 10.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.908 0.883 . . . . 0.0 109.441 177.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -97.12 -6.02 35.96 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.526 0.33 . . . . 0.0 110.49 175.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.83 -26.64 16.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.177 0.591 . . . . 0.0 111.509 -176.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 25.9 t -159.66 161.8 35.03 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.143 0.429 . . . . 0.0 111.261 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 22.9 t -88.4 170.94 10.5 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.833 0.853 . . . . 0.0 111.932 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.4 t -152.49 160.01 43.28 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.636 1.175 . . . . 0.0 109.204 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.38 -173.49 46.22 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.351 -0.452 . . . . 0.0 112.643 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.51 160.22 26.06 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.584 0.754 . . . . 0.0 110.728 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.2 mt -139.12 162.65 34.43 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 125.265 1.426 . . . . 0.0 108.907 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -152.55 146.85 25.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 122.284 -0.26 . . . . 0.0 111.144 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.5 m-90 -122.72 171.81 8.89 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.788 1.235 . . . . 0.0 112.526 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -77.48 -7.77 56.72 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.915 0.486 . . . . 0.0 111.134 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 38.6 t -155.47 159.58 39.9 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.639 -0.663 . . . . 0.0 111.402 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.52 -34.19 73.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.818 0.447 . . . . 0.0 110.521 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 73.5 m -75.55 -23.83 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.093 0.157 . . . . 0.0 110.785 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -71.79 -35.93 70.15 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.69 -28.75 60.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.525 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.42 -38.77 55.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.697 0.399 . . . . 0.0 111.561 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -72.31 -36.2 68.84 Favored 'General case' 0 C--O 1.233 0.187 0 O-C-N 121.697 -0.627 . . . . 0.0 109.51 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.27 -20.48 63.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.9 -40.18 79.29 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 173.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.32 -39.35 95.86 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 119.792 -0.449 . . . . 0.0 111.984 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . 0.429 ' C ' HD22 ' A' ' 559' ' ' LEU 0.26 6.6 m-85 -88.52 -16.41 32.73 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.279 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 558' ' ' PHE . 4.2 mm? -115.01 -9.07 12.43 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -72.4 147.55 46.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.783 1.174 . . . . 0.0 109.588 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.452 ' CD2' HD21 ' A' ' 479' ' ' ASN . 1.9 t-80 57.24 17.53 3.67 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 37.0 t80 -70.1 138.75 52.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 178.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.98 133.74 41.63 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.076 -0.39 . . . . 0.0 111.875 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.6 mtm -83.68 152.43 24.75 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.626 0.371 . . . . 0.0 111.156 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 172.223 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.5 p90 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -72.0 161.54 44.52 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.488 2.792 . . . . 0.0 111.297 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.89 142.38 50.67 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 102.545 -3.132 . . . . 0.0 102.545 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.256 0.7 OUTLIER -80.28 139.76 36.51 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.9 tt -84.47 152.17 24.14 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.414 1.085 . . . . 0.0 108.873 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.17 149.28 47.15 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 122.154 -0.341 . . . . 0.0 110.344 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.8 pp -153.95 162.63 41.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.106 0.479 . . . . 0.0 111.255 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 15.1 p -166.64 172.1 10.97 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.825 0.85 . . . . 0.0 110.75 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -56.14 127.23 29.63 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 33.2 t -81.97 148.89 28.45 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.259 1.0 OUTLIER -110.99 10.44 22.18 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 169.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.59 167.44 18.52 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.115 0.966 . . . . 0.0 111.491 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -93.99 -3.22 51.86 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -171.37 177.98 3.38 Favored 'General case' 0 C--N 1.338 0.101 0 C-N-CA 123.555 0.742 . . . . 0.0 110.16 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -134.92 21.33 3.51 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.812 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 178.137 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 N--CA 1.454 -0.803 0 N-CA-C 111.005 -0.421 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -154.85 158.9 40.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.94 165.11 23.85 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.074 0.55 . . . . 0.0 111.346 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -75.48 -7.28 53.72 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.9 t -157.65 147.95 15.81 Favored Pre-proline 0 CA--C 1.531 0.219 0 O-C-N 122.149 -0.345 . . . . 0.0 111.196 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.39 -13.81 22.22 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 124.028 3.152 . . . . 0.0 111.909 172.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.4 t -100.38 151.47 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.558 0.743 . . . . 0.0 112.785 -177.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -130.7 153.75 48.66 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.396 1.478 . . . . 0.0 108.32 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -137.9 128.59 26.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.108 0.413 . . . . 0.0 111.018 -175.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.86 153.57 27.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -142.56 173.5 11.48 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.33 9.72 78.93 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.22 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.2 mt -77.29 28.27 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.463 0.705 . . . . 0.0 111.849 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.65 -27.65 68.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -173.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.481 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -77.83 149.96 34.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 121.288 0.566 . . . . 0.0 111.16 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 48.2 t -68.46 -14.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.309 0.643 . . . . 0.0 112.635 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.3 -17.32 63.72 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 46.5 mmm -85.75 148.2 25.97 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 118.53 0.604 . . . . 0.0 110.866 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.79 158.71 28.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.378 0.671 . . . . 0.0 109.259 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 99.5 m -54.3 -40.6 68.06 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 122.322 0.249 . . . . 0.0 110.809 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.69 -38.69 77.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -75.95 -46.0 32.08 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.26 -40.64 80.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.403 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 2.4 t80 -76.15 -31.25 58.47 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -170.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.3 p30 -76.97 -28.44 55.14 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.714 1.143 . . . . 0.0 110.227 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.1 t -58.24 -57.79 9.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.566 1.7 p90 -76.56 -4.92 45.39 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 118.175 2.658 . . . . 0.0 118.175 173.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 42.7 t -73.85 -35.01 64.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.764 -0.585 . . . . 0.0 111.24 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.92 -12.41 11.1 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -87.92 -8.99 54.99 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 117.21 2.3 . . . . 0.0 117.21 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 176.87 -148.71 9.12 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.434 0.561 . . . . 0.0 112.733 -176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -107.12 130.43 54.69 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.102 0.561 . . . . 0.0 110.49 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.403 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.1 m -114.11 165.57 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -177.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -129.06 -53.71 1.2 Allowed 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -152.11 165.38 34.94 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.195 0.907 . . . . 0.0 113.045 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.87 147.04 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 124.6 1.16 . . . . 0.0 109.085 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -152.26 116.23 4.89 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.125 0.57 . . . . 0.0 111.376 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.86 158.08 29.6 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 115.821 1.786 . . . . 0.0 115.821 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -114.8 120.95 41.77 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.842 0.457 . . . . 0.0 112.123 -176.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -79.31 -13.06 59.89 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.9 0.48 . . . . 0.0 111.475 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 96.0 p -82.34 1.44 37.06 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.251 0.62 . . . . 0.0 111.895 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -139.81 157.15 70.3 Favored Pre-proline 0 C--N 1.34 0.153 0 C-N-CA 124.311 1.044 . . . . 0.0 109.306 -177.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -68.08 -16.91 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.97 2.446 . . . . 0.0 111.343 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.79 100.65 0.14 Allowed Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.58 158.86 34.72 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.531 0.733 . . . . 0.0 109.633 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -159.64 148.29 17.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.109 0.481 . . . . 0.0 112.078 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.4 mtp -94.34 154.53 17.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.14 0.976 . . . . 0.0 108.99 170.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -145.38 151.43 15.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -134.33 135.64 42.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 8.0 ptp -166.04 174.61 9.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.611 0.764 . . . . 0.0 110.138 -173.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.84 120.47 11.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -72.39 -33.39 67.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -168.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.76 -86.61 0.02 OUTLIER Glycine 0 C--N 1.335 0.495 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -71.59 -30.89 66.34 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.37 -36.4 20.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 119.259 -0.976 . . . . 0.0 112.403 -174.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -84.45 -28.3 6.95 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 C-N-CA 118.808 -1.157 . . . . 0.0 110.049 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.86 -46.7 67.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.79 175.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -39.03 89.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.246 -0.284 . . . . 0.0 110.941 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.43 91.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.795 -0.566 . . . . 0.0 110.29 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 59.9 mt -78.47 -8.77 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.283 0.633 . . . . 0.0 111.209 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 54.4 m -102.22 -18.22 15.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -127.48 -29.56 2.67 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -169.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 89.4 mt -134.67 -11.08 2.38 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.467 1.485 . . . . 0.0 114.368 -172.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.71 101.0 2.45 Favored 'General case' 0 C--O 1.205 -1.272 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -168.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.626 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 14.8 m-80 76.88 21.72 1.15 Allowed 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 123.333 2.788 . . . . 0.0 113.741 -161.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.07 162.23 17.7 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.258 58.0 m-85 -76.96 138.68 39.81 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -158.74 137.46 11.09 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.448 0.699 . . . . 0.0 109.484 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.1 m-85 57.23 25.34 10.93 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 117.266 2.321 . . . . 0.0 117.266 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.3 9.59 86.88 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 -177.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -135.81 -164.16 1.5 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.057 1.343 . . . . 0.0 108.52 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -129.06 146.65 50.97 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.108 -0.37 . . . . 0.0 111.281 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptm -118.96 75.14 1.01 Allowed 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.947 0.899 . . . . 0.0 109.442 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.626 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.4 m120 -53.0 125.23 16.53 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 116.272 -1.823 . . . . 0.0 112.192 -173.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.424 2.0 t -128.74 150.6 34.55 Favored 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 113.455 -3.298 . . . . 0.0 116.434 169.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.1 t -159.61 172.25 18.14 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.212 1.405 . . . . 0.0 107.807 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.5 p -72.3 147.28 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 18.9 t -82.51 156.65 23.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -96.6 -12.4 24.01 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.001 0.121 . . . . 0.0 110.954 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -83.75 153.45 64.33 Favored Pre-proline 0 N--CA 1.454 -0.252 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.03 -34.52 2.18 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.335 2.69 . . . . 0.0 112.306 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.52 159.04 11.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.177 0.444 . . . . 0.0 111.695 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 87.7 mt -83.72 150.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 173.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 62.0 mtm -125.5 130.24 24.16 Favored Pre-proline 0 CA--C 1.53 0.178 0 O-C-N 122.312 -0.243 . . . . 0.0 111.213 173.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.7 165.36 26.95 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.933 3.089 . . . . 0.0 110.87 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 147.62 -108.73 0.44 Allowed Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 177.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -72.51 162.43 29.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 120.837 0.351 . . . . 0.0 110.278 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.9 p -161.27 177.04 10.57 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.914 0.486 . . . . 0.0 110.321 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -144.46 163.44 33.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.96 162.62 54.39 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 121.11 0.283 . . . . 0.0 113.077 -174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.88 171.27 10.86 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.017 0.927 . . . . 0.0 109.94 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -69.33 -26.89 64.93 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.293 -0.254 . . . . 0.0 111.061 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -120.17 11.7 11.67 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.34 -171.6 28.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.801 -0.52 . . . . 0.0 111.801 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 70.2 m -124.91 -7.91 7.23 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -177.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.2 t -127.07 138.95 53.3 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 85.3 p -85.31 9.1 16.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.874 0.87 . . . . 0.0 111.627 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -138.24 151.61 47.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.09 146.51 25.58 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.691 0.396 . . . . 0.0 110.1 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -112.25 139.98 47.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -126.0 4.59 7.24 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 45.7 t -65.81 -20.64 66.32 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.915 0.486 . . . . 0.0 111.499 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -113.86 1.48 14.78 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.51 . . . . 0.0 111.423 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 42.3 t -77.67 147.28 35.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.894 0.378 . . . . 0.0 111.334 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.21 -8.32 48.86 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.816 0.447 . . . . 0.0 110.926 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -61.88 -20.03 63.29 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 122.76 0.424 . . . . 0.0 112.052 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -58.74 115.36 3.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.235 0.614 . . . . 0.0 109.627 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -74.78 -33.43 62.26 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -172.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -95.25 16.04 17.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.3 p -70.99 -10.9 60.55 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.4 149.94 67.08 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.94 -25.32 59.7 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.989 2.459 . . . . 0.0 111.614 176.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -75.49 -28.31 59.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.363 0.265 . . . . 0.0 110.698 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -81.97 -46.11 14.45 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.96 -16.97 61.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -78.19 -19.77 53.23 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.443 0.297 . . . . 0.0 111.785 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.04 -2.93 8.13 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.12 159.64 22.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.498 0.59 . . . . 0.0 110.317 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -151.79 145.94 25.35 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.3 mm -140.53 139.83 34.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.747 0.819 . . . . 0.0 109.356 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -150.11 166.38 29.96 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.179 0.991 . . . . 0.0 109.661 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.51 138.84 97.48 Favored Pre-proline 0 C--O 1.233 0.203 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.36 151.07 81.91 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.463 2.775 . . . . 0.0 111.339 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 83.1 p -148.42 -173.73 4.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.303 -175.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -83.74 4.72 27.61 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.813 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.15 137.97 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 73.3 mt -124.5 155.58 38.72 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.989 0.515 . . . . 0.0 109.782 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -121.75 144.44 48.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.352 1.061 . . . . 0.0 108.265 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -136.65 159.25 42.38 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.457 0.646 . . . . 0.0 110.688 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -152.27 168.45 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 103.722 -2.695 . . . . 0.0 103.722 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 57.61 57.49 4.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.678 0.391 . . . . 0.0 111.486 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -142.23 119.46 7.25 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 122.392 -0.193 . . . . 0.0 111.176 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.04 161.75 3.18 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 124.417 3.411 . . . . 0.0 113.219 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.52 -16.41 63.87 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.275 0.63 . . . . 0.0 111.914 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -94.07 -1.99 53.54 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.5 m -78.93 -11.5 13.15 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.9 m -55.25 179.07 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.226 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -168.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.655 ' H ' HG22 ' A' ' 510' ' ' THR . 89.0 tt0 12.09 -68.8 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.851 2.061 . . . . 0.0 114.189 175.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 510' ' ' THR . 95.8 mt-10 -54.36 -48.14 71.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -88.0 -23.57 23.77 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 121.941 2.155 . . . . 0.0 106.014 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -62.13 -40.8 97.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 118.259 -1.376 . . . . 0.0 113.468 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -72.61 -44.07 62.46 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -77.38 -18.9 56.93 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.491 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.5 mt -75.51 -39.16 40.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.116 0 CA-C-N 118.486 0.585 . . . . 0.0 109.509 173.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.8 -38.69 89.64 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.769 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -68.7 -29.36 67.78 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -75.08 -26.52 59.39 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.392 0.277 . . . . 0.0 110.775 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.72 -2.16 44.99 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 111.326 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.86 -0.7 61.22 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 123.295 0.474 . . . . 0.0 113.104 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.0 151.16 5.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.893 0.847 . . . . 0.0 112.206 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.42 149.84 49.72 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.937 0.398 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.94 152.92 91.02 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 123.112 0.565 . . . . 0.0 111.226 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.57 157.59 60.21 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.631 2.887 . . . . 0.0 110.529 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -89.22 -17.14 29.66 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.7 t -155.21 159.13 39.87 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.613 0.244 . . . . 0.0 111.421 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 62.6 t -143.13 144.93 23.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 C-N-CA 124.449 1.1 . . . . 0.0 110.09 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -148.18 140.97 24.66 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.18 143.74 29.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -154.89 -171.77 3.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.8 t -141.44 -172.15 3.46 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.765 0.826 . . . . 0.0 109.91 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 100.46 11.22 42.19 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 123.526 0.584 . . . . 0.0 112.373 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -126.95 -17.32 4.91 Favored 'General case' 0 C--N 1.339 0.148 0 CA-C-N 117.762 0.781 . . . . 0.0 112.593 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -163.56 152.96 14.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 117.876 0.307 . . . . 0.0 110.774 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.93 -8.09 31.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.921 0.489 . . . . 0.0 110.63 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -79.38 -41.85 26.86 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.254 0.622 . . . . 0.0 111.684 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.5 p -164.05 173.59 12.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 110.814 -173.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 45.5 p -83.44 177.74 8.33 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.547 0.689 . . . . 0.0 111.066 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.6 p -150.57 163.06 39.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.75 -169.67 42.65 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.827 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.33 160.28 23.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.448 0.699 . . . . 0.0 110.479 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.9 mt -139.27 157.96 44.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.858 1.263 . . . . 0.0 108.091 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -148.12 149.23 31.65 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.093 0.406 . . . . 0.0 111.995 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -127.12 175.06 8.41 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.351 1.461 . . . . 0.0 112.39 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -76.52 -12.3 60.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.609 0.364 . . . . 0.0 110.999 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.5 t -158.32 160.52 37.08 Favored 'General case' 0 C--O 1.232 0.163 0 O-C-N 121.808 -0.557 . . . . 0.0 110.851 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -75.15 -21.54 58.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.02 -0.425 . . . . 0.0 110.935 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.4 m -77.25 -25.67 51.73 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.019 0.372 . . . . 0.0 110.065 174.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -74.72 -34.05 62.51 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.245 0.618 . . . . 0.0 111.896 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.35 -28.96 57.03 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.386 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.5 tp -72.74 -39.25 67.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.734 0.243 . . . . 0.0 111.284 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -73.39 -39.03 65.41 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -26.27 62.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 176.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . 0.421 ' C ' HD13 ' A' ' 556' ' ' LEU . 1.6 tm? -68.11 -37.73 81.49 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 172.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.94 -30.05 75.51 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.559 -0.578 . . . . 0.0 112.325 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 7.5 m-85 -98.69 -8.25 26.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 118.924 2.935 . . . . 0.0 118.924 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.36 -8.69 10.51 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -72.05 145.36 48.31 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.354 0.979 . . . . 0.0 108.923 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.64 21.84 9.2 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.571 0.748 . . . . 0.0 112.326 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -61.54 134.24 56.62 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -81.11 121.21 25.82 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.047 -0.408 . . . . 0.0 110.732 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.8 152.61 18.33 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? . . . . . 0 C--O 1.233 0.2 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 169.364 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 6.6 p90 . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.51 168.85 14.28 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.689 2.926 . . . . 0.0 111.486 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -129.82 142.37 50.69 Favored 'General case' 0 N--CA 1.457 -0.109 0 N-CA-C 103.049 -2.945 . . . . 0.0 103.049 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.251 1.0 OUTLIER -81.67 131.3 35.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -178.053 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -78.5 149.29 33.17 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.03 147.25 46.09 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.566 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.92 159.84 38.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.647 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 20.4 p -160.81 174.74 13.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.024 0.929 . . . . 0.0 110.144 -177.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -58.09 124.45 19.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.3 t -79.76 149.52 31.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -171.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.266 0.8 OUTLIER -111.38 9.97 21.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 169.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.82 164.42 19.66 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.231 1.012 . . . . 0.0 111.863 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -92.83 -3.07 55.3 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.709 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -170.6 177.0 4.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.746 0.818 . . . . 0.0 110.074 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.41 28.33 1.2 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.072 0.549 . . . . 0.0 111.64 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 117.426 -1.273 . . . . 0.0 111.154 -177.797 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.456 -0.687 0 CA-C-O 120.974 0.323 . . . . 0.0 112.821 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -148.59 152.3 36.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.915 0.486 . . . . 0.0 110.728 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.72 26.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.066 0.547 . . . . 0.0 110.882 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -82.81 -0.93 50.23 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.1 t -156.96 144.77 14.08 Favored Pre-proline 0 C--O 1.232 0.151 0 C-N-CA 122.804 0.442 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.7 -15.29 33.56 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.209 2.606 . . . . 0.0 110.836 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.01 150.91 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.1 153.03 42.49 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.933 0.893 . . . . 0.0 109.707 -175.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . 0.432 ' O ' HG13 ' A' ' 448' ' ' VAL . 97.0 mmm -120.32 147.59 44.82 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 123.55 0.74 . . . . 0.0 111.39 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 5.9 p -139.65 146.2 25.67 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -143.21 173.71 11.35 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.56 61.75 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.673 -0.571 . . . . 0.0 111.673 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 20.7 mt -75.73 32.32 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.881 0.872 . . . . 0.0 111.481 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -71.08 14.29 0.16 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -174.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -137.12 149.57 47.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.126 0.571 . . . . 0.0 110.811 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 39.3 t -69.53 -13.63 62.43 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.495 0.718 . . . . 0.0 112.057 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -67.77 -20.61 65.24 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 122.676 0.39 . . . . 0.0 111.875 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 67.4 mtp -94.28 148.57 22.08 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.069 -0.394 . . . . 0.0 110.615 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.78 154.39 28.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.3 p -59.17 -30.69 68.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -176.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -70.09 -43.23 71.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -76.03 -42.1 48.84 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 41.4 t -69.32 -42.31 81.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -76.29 -29.99 57.59 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.805 -0.616 . . . . 0.0 111.19 -171.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -75.95 -31.04 58.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.344 0.975 . . . . 0.0 109.857 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.97 -55.63 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.55 1.8 p90 -76.59 -4.86 45.12 Favored 'General case' 0 C--N 1.339 0.147 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.8 t -72.39 -34.31 67.82 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 122.008 -0.432 . . . . 0.0 110.867 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.52 -14.46 19.88 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.096 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.33 -3.48 58.46 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.6 -174.83 43.29 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 119.193 0.906 . . . . 0.0 113.262 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -76.34 130.12 37.62 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -129.93 -61.3 1.0 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 176.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -148.39 165.13 32.02 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -170.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.37 145.01 21.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 124.774 1.23 . . . . 0.0 108.485 171.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -153.7 121.49 5.98 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -76.98 166.93 22.66 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.8 ptp -142.82 138.0 30.04 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 118.879 0.763 . . . . 0.0 112.714 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -5.56 53.98 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.706 1.202 . . . . 0.0 112.156 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.0 t -78.06 -4.97 49.9 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.214 0.605 . . . . 0.0 111.646 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.49 155.57 67.15 Favored Pre-proline 0 CA--C 1.53 0.184 0 C-N-CA 123.993 0.917 . . . . 0.0 109.918 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 -13.75 38.14 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.392 2.728 . . . . 0.0 111.894 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.43 87.27 0.07 OUTLIER Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -152.48 160.44 43.25 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.963 0.505 . . . . 0.0 110.838 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.61 170.43 22.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.663 0.385 . . . . 0.0 110.434 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 22.1 mtm -123.97 157.34 34.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.034 0.934 . . . . 0.0 108.828 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -142.0 152.03 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.756 0.822 . . . . 0.0 110.38 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.73 132.87 42.78 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtp -155.13 172.39 18.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -171.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.08 127.05 30.6 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 170.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -73.07 -34.76 66.43 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -168.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.11 -89.1 0.01 OUTLIER Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -72.78 -26.54 61.57 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.7 -36.43 17.4 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 118.838 -1.145 . . . . 0.0 111.668 -174.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.79 -27.31 6.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.205 0 C-N-CA 118.553 -1.259 . . . . 0.0 109.374 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -68.77 -53.39 22.05 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.108 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 25.6 mtm180 -68.9 -29.99 68.39 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.05 78.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.094 -0.643 . . . . 0.0 110.011 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.72 -9.97 12.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.303 0.641 . . . . 0.0 111.084 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 29.9 m -96.77 -21.33 17.61 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -125.79 -26.9 3.41 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -169.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 88.1 mt -134.59 -8.75 2.48 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.906 1.684 . . . . 0.0 114.624 -172.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.637 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.2 p-10 -71.63 101.09 2.43 Favored 'General case' 0 C--O 1.207 -1.157 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -168.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.573 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 16.3 m-80 77.47 22.02 0.97 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 123.98 3.082 . . . . 0.0 114.054 -160.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -76.87 163.06 27.12 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.906 -1.121 . . . . 0.0 110.207 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -68.71 136.61 53.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 173.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.9 ttt -158.43 142.26 15.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 554' ' ' GLU 0.273 53.2 m-85 59.92 15.63 5.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.16 9.17 70.74 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -136.03 -171.14 2.8 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.497 1.119 . . . . 0.0 108.439 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -128.43 136.2 50.54 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.088 -0.383 . . . . 0.0 110.795 178.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -94.82 -152.51 0.36 Allowed 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 31.4 t-20 -159.22 129.28 5.69 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 115.903 -1.999 . . . . 0.0 110.521 175.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.637 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.459 2.1 t -124.03 145.25 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 112.864 -3.534 . . . . 0.0 115.147 167.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -161.29 164.76 29.99 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.869 0.868 . . . . 0.0 109.442 -176.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.4 p -75.29 150.69 6.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 37.0 t -93.29 158.09 15.92 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.726 0.81 . . . . 0.0 111.997 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -96.85 -7.88 32.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.667 0.387 . . . . 0.0 110.552 175.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -71.01 147.52 93.9 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.494 0.717 . . . . 0.0 110.526 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.9 -32.91 2.39 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.195 2.597 . . . . 0.0 111.435 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.77 158.87 9.34 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.544 0.738 . . . . 0.0 110.395 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 67.5 mt -82.89 133.42 29.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 34.2 mmm -98.0 129.32 31.3 Favored Pre-proline 0 N--CA 1.454 -0.274 0 C-N-CA 122.374 0.27 . . . . 0.0 111.241 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.32 161.95 37.04 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.437 2.758 . . . . 0.0 109.024 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 151.76 -129.52 2.85 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 121.128 -0.558 . . . . 0.0 111.899 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -72.32 171.3 12.43 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.267 0.627 . . . . 0.0 111.149 -177.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.6 p -156.01 170.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.538 0.735 . . . . 0.0 109.403 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -128.75 5.88 5.55 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.39 -170.95 55.16 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.215 -0.303 . . . . 0.0 112.499 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.3 mt -143.01 168.35 19.91 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.081 0.952 . . . . 0.0 109.592 -178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -75.22 -24.34 57.71 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 122.364 -0.21 . . . . 0.0 110.45 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -120.61 20.27 11.8 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.618 0.767 . . . . 0.0 110.825 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.33 167.32 36.86 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.604 -0.685 . . . . 0.0 112.289 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 t -93.66 -26.67 16.95 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.73 0.412 . . . . 0.0 112.111 -176.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.7 t -127.02 148.03 50.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.986 0.515 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.4 p -90.17 7.94 35.48 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.394 0.678 . . . . 0.0 111.418 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -134.34 145.82 49.37 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -156.57 151.73 26.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.888 0.375 . . . . 0.0 110.663 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.1 130.32 41.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.587 0.755 . . . . 0.0 112.25 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.54 -12.03 41.12 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 117.542 2.423 . . . . 0.0 117.542 -173.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 43.9 t -68.93 -29.93 68.27 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.641 0.257 . . . . 0.0 110.357 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -80.0 -18.38 50.4 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.699 0.399 . . . . 0.0 111.117 177.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.2 m -93.87 -4.0 50.78 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.873 0.469 . . . . 0.0 112.056 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 478' ' ' ARG . 0.1 OUTLIER 61.66 3.96 0.96 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.311 1.044 . . . . 0.0 112.83 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -59.61 -17.64 34.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -57.05 122.27 11.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.247 0.619 . . . . 0.0 110.625 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -81.05 -33.66 33.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.304 64.7 m-85 -98.0 10.46 40.29 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 117.376 2.362 . . . . 0.0 117.376 -178.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 86.5 p -71.79 -10.72 60.19 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -135.96 148.98 67.19 Favored Pre-proline 0 C--O 1.232 0.136 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 179.623 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.47 -24.63 63.64 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 123.237 2.625 . . . . 0.0 111.554 176.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -73.97 -27.5 61.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.344 0.257 . . . . 0.0 110.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -88.44 -43.17 11.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 175.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.39 63.79 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.48 -18.61 44.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -124.06 -4.9 7.94 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -62.93 158.97 17.85 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.105 0.411 . . . . 0.0 110.752 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -150.03 144.91 26.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.5 mm -136.29 153.03 30.69 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 C-N-CA 123.891 0.876 . . . . 0.0 108.724 -175.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -155.01 162.26 41.13 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -57.28 153.01 28.54 Favored Pre-proline 0 CA--C 1.531 0.225 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -63.81 143.41 86.06 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.923 2.416 . . . . 0.0 109.644 -177.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.4 t -153.63 171.93 18.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.774 0.43 . . . . 0.0 110.205 -173.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -83.73 2.31 38.48 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.265 -0.272 . . . . 0.0 110.877 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.39 137.81 24.82 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 71.0 mt -125.39 156.09 39.34 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.081 0.553 . . . . 0.0 109.691 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -125.09 132.79 53.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -120.96 160.59 23.21 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 111.505 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -147.79 153.6 39.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 28.0 m120 55.52 57.47 5.32 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.072 -175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -113.6 153.06 45.9 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 122.897 0.479 . . . . 0.0 110.205 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -57.7 153.63 41.84 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.493 2.795 . . . . 0.0 112.696 -177.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.65 -16.3 63.79 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.381 0.672 . . . . 0.0 112.059 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -122.95 25.0 8.77 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.484 0.714 . . . . 0.0 110.95 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.61 -9.35 10.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 512' ' ' GLU . 0.2 OUTLIER -54.88 -177.29 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 117.214 -1.374 . . . . 0.0 114.222 -165.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.506 ' H ' HG22 ' A' ' 510' ' ' THR . 8.8 pm0 -30.86 -33.55 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.397 1.453 . . . . 0.0 114.77 -167.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.0 mt-10 -60.3 -45.64 92.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 117.047 -1.454 . . . . 0.0 114.723 170.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -87.53 -30.03 20.89 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 122.745 2.52 . . . . 0.0 106.528 -173.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -62.44 -33.81 75.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -76.15 -42.71 45.8 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -79.84 -19.27 48.77 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.659 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.2 -44.87 42.75 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 118.698 0.681 . . . . 0.0 110.081 175.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.6 m -64.19 -33.93 76.91 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.902 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -67.28 -37.39 83.35 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.013 0.435 . . . . 0.0 112.01 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -74.46 -30.71 61.98 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.707 0.403 . . . . 0.0 111.124 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.35 -4.61 58.99 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.649 0.379 . . . . 0.0 111.926 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 71.95 33.6 62.58 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.62 159.63 42.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.57 0.748 . . . . 0.0 112.889 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.08 149.09 50.83 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.138 0.575 . . . . 0.0 111.736 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -91.13 157.13 43.33 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.572 0.749 . . . . 0.0 111.023 -178.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -68.23 160.83 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.575 2.85 . . . . 0.0 111.196 174.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -97.87 -18.6 18.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 38.1 m -148.49 156.34 42.33 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.671 . . . . 0.0 110.959 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 59.7 t -143.98 148.22 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.543 0.737 . . . . 0.0 110.863 -175.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -147.35 142.36 27.02 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 123.804 0.842 . . . . 0.0 108.884 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -140.51 142.82 30.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 122.99 0.516 . . . . 0.0 112.282 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -156.09 -175.61 5.52 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -178.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.2 p -142.71 -169.09 2.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.465 1.106 . . . . 0.0 109.336 178.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.43 8.85 62.25 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.698 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.02 9.62 2.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 117.699 0.749 . . . . 0.0 111.371 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 42.5 t -158.63 157.62 32.24 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.765 0.826 . . . . 0.0 109.543 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -116.96 -5.34 11.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.996 0.518 . . . . 0.0 111.037 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -89.91 -50.17 6.19 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 122.843 0.457 . . . . 0.0 112.205 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 80.6 p -165.53 179.0 6.35 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 122.77 0.428 . . . . 0.0 110.94 -177.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 74.3 m -70.22 168.95 14.69 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.8 t -147.07 163.96 34.58 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.58 1.552 . . . . 0.0 108.398 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.12 -171.92 44.92 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.126 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.82 160.31 22.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.8 0.84 . . . . 0.0 110.484 -177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.3 mt -140.66 158.16 44.38 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.647 1.179 . . . . 0.0 108.936 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -148.72 152.21 36.23 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 117.607 0.185 . . . . 0.0 111.228 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.4 m-90 -128.42 167.84 16.45 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.869 1.268 . . . . 0.0 112.785 -177.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -70.53 -8.32 50.42 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -158.44 161.22 37.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.51 0.324 . . . . 0.0 110.932 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -66.13 -34.83 78.94 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.906 0.482 . . . . 0.0 110.219 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.9 p -78.35 -25.82 46.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.425 0.29 . . . . 0.0 110.893 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -68.79 -35.34 76.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.39 65.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 48.0 tp -65.51 -40.06 92.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.613 0.244 . . . . 0.0 110.585 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . 0.484 ' HG3' ' CE1' ' A' ' 442' ' ' PHE . 39.8 tt0 -64.27 -47.93 77.67 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.479 0.657 . . . . 0.0 110.712 177.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.86 -19.2 61.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.62 -44.29 82.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 173.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.9 -45.69 96.03 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.284 19.0 m-85 -76.86 -32.02 57.22 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 119.103 3.001 . . . . 0.0 119.103 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 57.8 mt -90.73 -19.29 23.71 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 119.504 1.047 . . . . 0.0 112.933 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -73.99 145.34 44.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.131 0.878 . . . . 0.0 110.118 -178.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 57.54 12.62 1.58 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.431 1.093 . . . . 0.0 113.091 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 40.1 t80 -72.9 138.83 46.45 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -71.73 132.83 45.08 Favored 'General case' 0 N--CA 1.457 -0.114 0 O-C-N 122.212 -0.305 . . . . 0.0 111.706 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.1 mtm -83.73 152.56 24.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.59 0.356 . . . . 0.0 110.96 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.471 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.1 p90 . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 116.232 1.938 . . . . 0.0 116.232 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.77 164.46 33.56 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.806 3.004 . . . . 0.0 111.746 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -129.98 142.35 50.64 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 103.047 -2.945 . . . . 0.0 103.047 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -76.65 142.21 40.7 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.864 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.1 tt -83.88 150.32 25.79 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.196 0.998 . . . . 0.0 108.457 173.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -134.0 151.38 51.42 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 118.475 0.58 . . . . 0.0 111.147 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.4 pp -159.46 167.69 28.07 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.104 0.478 . . . . 0.0 111.43 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 12.5 p -162.6 174.05 13.13 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.293 1.037 . . . . 0.0 110.409 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -57.36 121.38 10.05 Favored 'General case' 0 C--N 1.34 0.156 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.9 t -77.83 149.15 34.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -170.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 0.6 OUTLIER -110.98 9.93 22.19 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 114.7 1.371 . . . . 0.0 114.7 169.545 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.22 166.57 16.06 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.161 0.984 . . . . 0.0 111.84 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -93.32 -3.03 54.21 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.84 177.97 3.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.575 0.75 . . . . 0.0 110.04 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -144.62 31.8 1.18 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.762 0.425 . . . . 0.0 111.607 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.89 -178.864 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo . . . . . 0 N--CA 1.452 -0.915 0 N-CA-C 110.719 -0.531 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -147.89 154.59 40.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 120.868 0.366 . . . . 0.0 110.815 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.43 161.14 30.1 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.151 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -75.44 -5.71 46.42 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.2 t -158.71 146.7 13.68 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 122.895 0.478 . . . . 0.0 110.553 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.21 -16.79 40.12 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.288 2.659 . . . . 0.0 110.519 174.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.57 148.77 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.7 tt -137.6 152.0 48.93 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.771 1.229 . . . . 0.0 107.966 -178.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.1 tpt -134.59 130.11 35.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.397 0.142 . . . . 0.0 110.779 -172.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.68 152.85 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -139.91 172.16 13.17 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 104.624 -2.361 . . . . 0.0 104.624 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.84 9.42 77.8 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 120.141 -0.255 . . . . 0.0 112.653 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.8 mt -79.02 27.89 0.23 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.553 0.676 . . . . 0.0 112.244 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.81 -41.46 95.77 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -67.04 146.22 54.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.051 0.453 . . . . 0.0 111.016 -178.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 56.6 m -68.68 -10.12 54.34 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -173.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -73.17 -19.62 61.08 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 117.939 0.336 . . . . 0.0 111.612 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 86.8 mmm -82.32 146.65 29.29 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.157 0.435 . . . . 0.0 110.587 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -160.92 155.74 23.89 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -59.13 -36.79 75.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -176.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -68.23 -39.33 82.37 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -75.93 -47.51 24.9 Favored 'General case' 0 C--N 1.34 0.153 0 O-C-N 122.192 -0.318 . . . . 0.0 111.651 -173.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.38 -37.74 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.8 -31.84 57.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -75.94 -29.9 58.51 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.703 1.138 . . . . 0.0 110.296 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -60.13 -55.8 21.74 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 2.5 p90 -76.57 -3.93 40.18 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 117.505 2.409 . . . . 0.0 117.505 174.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 40.6 t -74.95 -35.0 62.14 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.059 -0.401 . . . . 0.0 110.803 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.09 -15.83 26.66 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.13 -7.39 59.64 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 117.295 2.331 . . . . 0.0 117.295 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.64 -143.21 6.99 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 -176.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -113.77 132.94 55.66 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.801 0.44 . . . . 0.0 110.773 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.5 8.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -117.63 -67.42 0.99 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -154.45 170.51 21.21 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.73 148.48 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.066 0 C-N-CA 123.845 0.858 . . . . 0.0 109.42 -177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -152.31 108.52 3.4 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 122.576 0.351 . . . . 0.0 111.415 -174.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -73.24 163.88 27.48 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 24.0 ptp -142.18 142.03 32.66 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -5.57 54.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.742 1.617 . . . . 0.0 112.987 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.6 t -77.87 -8.18 57.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.109 0.563 . . . . 0.0 112.238 -172.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -141.03 157.52 66.89 Favored Pre-proline 0 CA--C 1.528 0.12 0 C-N-CA 123.644 0.777 . . . . 0.0 109.598 -177.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -67.54 -12.23 34.92 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.181 2.588 . . . . 0.0 111.496 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.05 95.4 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.56 160.41 38.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.208 0.603 . . . . 0.0 110.05 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.03 153.95 23.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.22 0.533 . . . . 0.0 111.732 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 83.3 mtp -96.97 153.29 17.99 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.948 0.899 . . . . 0.0 108.985 172.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.8 t -145.51 153.83 13.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -139.07 134.29 32.75 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 30.3 mtp -151.86 173.31 14.94 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 123.757 0.823 . . . . 0.0 109.388 -170.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.31 125.07 23.92 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 169.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.93 -33.1 65.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -167.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.17 -89.33 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -73.74 -23.69 59.79 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.97 -32.56 15.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 118.737 -1.185 . . . . 0.0 112.107 -175.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.2 -25.06 6.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 120.179 1.354 . . . . 0.0 109.082 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -68.53 -50.15 54.2 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 118.056 0.389 . . . . 0.0 111.302 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.64 -37.0 85.32 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.35 80.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.732 0.697 . . . . 0.0 110.674 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.2 mt -77.72 -12.76 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 123.028 0.531 . . . . 0.0 110.81 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.8 m -96.8 -18.96 19.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.449 ' C ' HD22 ' A' ' 436' ' ' LEU . 92.9 m-70 -129.5 -25.76 2.6 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 116.161 1.912 . . . . 0.0 116.161 -169.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.9 mm? -129.52 -14.32 4.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.144 1.338 . . . . 0.0 113.473 -172.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.662 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.94 100.91 2.55 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -168.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.1 m-80 76.69 21.27 1.28 Allowed 'General case' 0 N--CA 1.481 1.088 0 O-C-N 117.916 -2.99 . . . . 0.0 112.264 -162.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -84.03 157.45 21.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -77.51 139.37 39.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.6 ttt -159.12 138.61 11.55 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.022 0.529 . . . . 0.0 109.597 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.399 49.8 m-85 56.92 25.79 10.95 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 -178.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 77.95 10.33 86.3 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 111.501 -0.639 . . . . 0.0 111.501 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -134.83 -167.3 1.96 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.861 1.264 . . . . 0.0 108.913 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -132.29 147.81 52.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.285 0.234 . . . . 0.0 111.031 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 18.7 ptt? -125.36 87.23 2.67 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 176.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.0 m120 -55.45 128.35 33.92 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 115.634 -2.127 . . . . 0.0 111.907 -174.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.662 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.423 2.4 t -126.82 154.15 36.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.28 -3.368 . . . . 0.0 116.059 169.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 37.9 t -162.09 167.42 24.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.568 1.547 . . . . 0.0 107.757 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.93 147.91 10.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 26.2 t -79.44 165.18 23.33 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 122.52 0.328 . . . . 0.0 110.5 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.4 31.56 6.27 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . 0.412 ' HB2' ' HD2' ' A' ' 454' ' ' PRO . 12.0 pt20 -137.12 160.91 64.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' A' ' 453' ' ' GLN . 83.3 Cg_endo -75.0 -37.1 2.18 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.986 2.457 . . . . 0.0 116.198 -167.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -166.01 154.5 11.06 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.946 1.248 . . . . 0.0 112.889 -176.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 66.0 mt -77.05 150.83 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 173.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 54.9 mtm -129.27 136.79 29.7 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 117.584 0.175 . . . . 0.0 111.319 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.78 168.75 23.65 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.085 3.19 . . . . 0.0 110.564 177.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 143.37 -115.04 0.88 Allowed Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -72.43 153.55 41.35 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.1 0.56 . . . . 0.0 110.454 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 46.9 m -152.96 172.56 16.62 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.135 0.974 . . . . 0.0 110.03 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -144.58 164.07 32.01 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -83.38 132.08 10.83 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.22 163.37 26.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 174.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.69 -18.52 64.95 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -120.55 23.11 10.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.102 0.561 . . . . 0.0 109.931 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.97 -162.31 15.75 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.691 -0.631 . . . . 0.0 112.351 -176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 98.2 p -133.1 -10.74 2.95 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 122.727 0.411 . . . . 0.0 112.001 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.1 t -127.09 155.9 42.55 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.912 0.485 . . . . 0.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 80.2 p -115.72 8.96 15.07 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.446 0.698 . . . . 0.0 111.794 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -135.5 146.29 47.96 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -155.37 157.65 37.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.468 0.175 . . . . 0.0 110.64 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -128.77 139.35 52.24 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -173.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -133.78 5.07 3.63 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 31.9 t -65.39 -22.69 66.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.266 0.627 . . . . 0.0 111.825 -174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -113.89 1.48 14.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.156 0.582 . . . . 0.0 111.479 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -79.66 153.33 29.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.526 0.33 . . . . 0.0 111.365 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -85.42 -7.51 58.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.509 0.324 . . . . 0.0 111.283 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . 0.456 HD21 ' CD2' ' A' ' 561' ' ' HIS . 5.6 m-20 -60.13 -20.74 59.81 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -60.5 127.61 32.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -70.11 -33.76 72.25 Favored 'General case' 0 N--CA 1.458 -0.066 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -170.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.363 55.8 m-85 -98.14 17.53 18.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.5 t -60.0 -28.57 67.83 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -172.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.56 155.32 75.37 Favored Pre-proline 0 C--N 1.339 0.129 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -178.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.27 -25.37 76.64 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.306 2.671 . . . . 0.0 112.066 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -74.65 -29.75 61.37 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -80.43 -45.42 17.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.78 66.12 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.6 -25.0 56.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.936 0.335 . . . . 0.0 111.609 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -124.02 3.84 8.67 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -61.19 154.7 22.64 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.425 0.557 . . . . 0.0 111.679 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -154.63 141.87 19.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.0 mm -137.22 148.66 26.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.648 0.779 . . . . 0.0 109.337 -174.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -148.52 170.03 18.96 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.512 0.725 . . . . 0.0 110.59 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -64.43 157.09 74.13 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.71 148.32 90.16 Favored 'Trans proline' 0 N--CA 1.448 -1.197 0 C-N-CA 122.524 2.15 . . . . 0.0 109.808 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.9 t -153.95 173.66 15.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.815 0.446 . . . . 0.0 109.839 -173.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -83.74 -3.18 57.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.279 -0.263 . . . . 0.0 110.732 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -96.95 138.22 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 176.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 65.6 mt -125.5 156.52 38.85 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.19 0.596 . . . . 0.0 109.862 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -124.53 143.42 50.68 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -132.96 160.13 37.98 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.977 0.418 . . . . 0.0 111.452 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -144.16 150.96 38.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 51.83 57.42 6.54 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.304 1.042 . . . . 0.0 112.587 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -104.14 156.33 35.89 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.512 0.725 . . . . 0.0 110.302 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.83 153.04 32.65 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.317 2.678 . . . . 0.0 112.742 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.67 -16.34 63.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.442 0.697 . . . . 0.0 112.047 -176.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -122.92 20.99 9.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.523 0.729 . . . . 0.0 110.949 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.74 -16.12 19.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.47 -177.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -165.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.677 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -22.72 -41.04 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -170.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.2 mt-10 -58.49 -47.53 83.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 117.268 -1.349 . . . . 0.0 114.358 172.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -87.0 -28.32 22.71 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 122.416 2.371 . . . . 0.0 106.776 -172.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -65.35 -37.57 87.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 119.22 -0.992 . . . . 0.0 113.599 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -75.98 -37.66 58.28 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -81.71 -22.16 37.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.491 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.1 mt -75.94 -41.46 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 CA-C-N 118.624 0.647 . . . . 0.0 110.065 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.0 m -67.88 -34.77 77.31 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.089 0.404 . . . . 0.0 111.092 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.51 -34.74 72.65 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -69.19 -25.13 64.18 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.494 0.317 . . . . 0.0 110.922 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.81 -5.18 35.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.332 0.653 . . . . 0.0 111.552 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.2 -3.86 43.96 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.473 0.559 . . . . 0.0 113.02 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.8 m -78.79 164.56 3.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 CA-C-N 117.777 0.789 . . . . 0.0 112.522 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -67.37 149.1 50.75 Favored 'General case' 0 C--N 1.338 0.088 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -84.17 149.06 54.78 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.889 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.33 150.0 70.28 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.127 2.551 . . . . 0.0 110.589 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -85.24 -18.18 34.77 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 35.7 m -150.51 155.44 39.49 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.41 0.684 . . . . 0.0 110.982 176.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 91.7 t -144.01 147.92 19.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 123.644 0.777 . . . . 0.0 110.072 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -149.71 141.75 23.91 Favored 'General case' 0 N--CA 1.457 -0.081 0 C-N-CA 123.311 0.644 . . . . 0.0 109.369 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.71 142.74 31.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 123.227 0.611 . . . . 0.0 112.089 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -155.94 -173.8 4.68 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 99.0 p -138.53 -171.08 2.97 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.276 1.031 . . . . 0.0 110.115 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.52 7.77 57.79 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 119.779 -0.456 . . . . 0.0 112.326 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -125.56 -14.03 6.41 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 117.594 0.697 . . . . 0.0 112.154 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 34.8 t -162.23 148.31 13.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.861 0.464 . . . . 0.0 110.502 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -97.76 -8.07 29.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.916 0.486 . . . . 0.0 110.614 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -85.03 -38.64 18.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.245 0.618 . . . . 0.0 112.116 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 3.6 m -161.82 165.41 27.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.938 0.495 . . . . 0.0 111.816 -172.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 66.2 m -80.04 170.21 16.78 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.612 0.765 . . . . 0.0 111.697 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.2 m -142.97 165.06 28.38 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 124.392 1.077 . . . . 0.0 108.688 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.0 -170.08 43.23 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.046 -178.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.84 158.81 29.47 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.908 0.883 . . . . 0.0 110.349 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.3 mt -139.96 158.71 43.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 108.665 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.6 148.63 28.87 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.171 -0.331 . . . . 0.0 111.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -123.77 170.91 10.06 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 124.818 1.247 . . . . 0.0 112.644 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.81 -10.64 59.7 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.739 0.415 . . . . 0.0 111.037 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -156.48 160.39 39.51 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.678 -0.639 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -69.81 -30.67 68.25 Favored 'General case' 0 C--N 1.337 0.055 0 C-N-CA 122.412 0.285 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.4 p -75.36 -27.38 59.12 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -74.16 -32.49 63.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.597 0.359 . . . . 0.0 111.22 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.21 -36.95 58.35 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 175.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 37.3 tp -70.57 -37.4 73.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.321 -0.237 . . . . 0.0 111.446 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -70.69 -39.82 73.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.251 0.8 OUTLIER -68.99 -20.25 64.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 175.261 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.05 -42.55 89.37 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.18 -30.13 75.27 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.684 -0.509 . . . . 0.0 111.949 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.337 9.6 m-85 -96.74 -2.97 43.27 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 66.0 mt -127.25 -9.13 5.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -73.87 147.01 43.65 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.689 1.132 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.456 ' CD2' HD21 ' A' ' 479' ' ' ASN . 2.0 t-80 57.58 22.12 7.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.807 0.843 . . . . 0.0 112.204 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.34 134.78 56.95 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -77.16 119.29 20.64 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 122.285 -0.26 . . . . 0.0 110.729 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 74.6 mtm -83.57 152.69 24.73 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.148 0.499 . . . . 0.0 112.107 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt . . . . . 0 N--CA 1.455 -0.21 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.123 170.925 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 114.598 1.332 . . . . 0.0 114.598 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.15 162.97 40.3 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.953 2.435 . . . . 0.0 110.849 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -129.91 142.31 50.67 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 103.348 -2.834 . . . . 0.0 103.348 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.6 OUTLIER -85.08 139.06 32.02 Favored 'General case' 0 CA--C 1.528 0.135 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -176.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 4.6 tt -85.22 145.79 27.4 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.47 151.92 51.84 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.044 -0.663 . . . . 0.0 111.036 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.62 165.14 37.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.583 0.552 . . . . 0.0 111.678 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 23.0 p -163.78 175.81 10.13 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.192 0.997 . . . . 0.0 110.257 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -58.89 125.49 23.77 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.6 t -82.17 152.07 26.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -171.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.3 t -118.26 12.71 13.53 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 169.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.05 161.3 24.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.826 0.85 . . . . 0.0 111.907 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -92.08 -3.2 56.05 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.414 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -152.84 169.98 21.46 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 123.84 0.856 . . . . 0.0 110.477 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.49 25.86 0.96 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.644 0.778 . . . . 0.0 110.148 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.502 -175.947 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 121.047 0.353 . . . . 0.0 112.969 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -150.0 155.99 40.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.276 0.63 . . . . 0.0 110.019 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.53 160.34 27.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.709 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.13 -0.92 33.68 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . 0.412 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 36.1 t -155.19 148.58 18.49 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.921 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 44.2 Cg_exo -60.79 -4.07 3.26 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 124.539 3.493 . . . . 0.0 113.945 176.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 p -139.67 157.22 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.106 0 CA-C-O 121.514 0.673 . . . . 0.0 109.319 -174.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.95 160.71 26.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.76 1.624 . . . . 0.0 109.09 -174.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 17.3 tpt -136.65 133.65 36.45 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 122.566 0.347 . . . . 0.0 110.717 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -126.93 152.68 35.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -140.26 173.88 11.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.14 11.81 75.17 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.396 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 47.7 mt -78.74 23.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 117.396 0.598 . . . . 0.0 111.181 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.27 10.5 p30 -74.24 26.85 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -173.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.46 156.55 45.18 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.282 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 25.6 m -68.44 -7.29 30.54 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.422 0.689 . . . . 0.0 112.362 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.27 -14.71 61.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 94.2 mmm -100.99 149.6 23.76 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.516 0.598 . . . . 0.0 111.586 -178.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -157.19 151.03 24.47 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.88 0.872 . . . . 0.0 109.336 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.0 p -59.27 -39.45 82.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -174.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -72.02 -34.82 69.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.316 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -76.09 -48.26 21.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.452 0.301 . . . . 0.0 111.499 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.5 p -67.42 -37.4 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -76.9 -32.06 57.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -171.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -76.2 -32.44 58.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 119.589 1.086 . . . . 0.0 110.114 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.21 -54.62 30.06 Favored 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.8 OUTLIER -76.52 -4.18 41.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 172.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.338 0.073 0 O-C-N 121.912 -0.492 . . . . 0.0 110.428 177.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . 0.416 ' C ' HD12 ' A' ' 402' ' ' LEU . 2.9 pp -58.11 -18.23 23.7 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.973 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -82.86 -10.48 58.82 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.94 -156.47 24.84 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 118.345 0.52 . . . . 0.0 112.287 -176.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -96.94 131.61 43.55 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.546 -0.385 . . . . 0.0 111.052 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.51 8.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -119.18 -70.68 0.78 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 14.8 pttp -154.48 168.36 26.97 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.2 p -137.32 149.8 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.187 0.995 . . . . 0.0 110.704 -177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -150.72 121.31 7.45 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.316 0.646 . . . . 0.0 111.51 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -85.21 158.92 20.22 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 13.4 mmt -116.37 133.49 55.95 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 32.3 mttp -79.36 -23.79 43.11 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 124.254 1.022 . . . . 0.0 111.619 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.3 t -77.81 -19.63 54.64 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -170.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -113.12 156.96 42.14 Favored Pre-proline 0 CA--C 1.527 0.094 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.32 -15.17 47.23 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.617 2.211 . . . . 0.0 110.451 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.27 106.09 0.2 Allowed Glycine 0 C--N 1.338 0.642 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 175.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.83 157.36 29.06 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.41 0.684 . . . . 0.0 110.044 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.12 156.42 21.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.599 0.237 . . . . 0.0 111.636 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 64.5 mtm -102.49 154.11 19.42 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.338 0.655 . . . . 0.0 109.75 171.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 12.0 t -140.27 115.13 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 122.88 0.472 . . . . 0.0 111.23 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -93.77 133.42 37.16 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 44.3 mtp -154.75 172.43 17.95 Favored 'General case' 0 C--N 1.335 -0.045 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -171.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.69 118.13 8.47 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 168.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -72.4 -33.37 67.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -167.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.17 -88.27 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -71.65 -30.62 65.94 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.17 -32.71 18.48 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.564 -0.855 . . . . 0.0 112.729 -173.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 61.1 t -88.38 -24.08 6.22 Favored 'Isoleucine or valine' 0 C--N 1.343 0.296 0 CA-C-N 119.987 1.267 . . . . 0.0 109.685 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -66.07 -50.82 62.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.408 172.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -64.27 -34.51 78.29 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.23 82.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.5 0.591 . . . . 0.0 110.296 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.1 mt -79.17 -8.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.223 0.609 . . . . 0.0 111.089 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 37.6 m -100.61 -18.79 16.41 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 177.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -125.73 -29.82 3.1 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 -169.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 94.6 mt -134.36 -10.06 2.52 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 120.449 1.477 . . . . 0.0 114.151 -170.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.655 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.2 p-10 -71.38 100.74 2.24 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.8 m-80 76.72 21.44 1.24 Allowed 'General case' 0 N--CA 1.479 1.025 0 O-C-N 117.795 -3.066 . . . . 0.0 112.477 -162.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -79.61 158.44 27.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 170.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.29 46.7 m-85 -72.85 42.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -174.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . 0.422 ' HG2' ' CD2' ' A' ' 442' ' ' PHE . 16.0 ttt -59.74 145.98 43.14 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.791 -0.568 . . . . 0.0 110.43 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . 0.422 ' CD2' ' HG2' ' A' ' 441' ' ' MET 0.289 62.0 m-85 55.92 8.82 0.39 Allowed 'General case' 0 C--O 1.231 0.104 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 72.62 13.58 77.95 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -175.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -133.02 -4.41 3.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.672 0.736 . . . . 0.0 112.19 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 62.99 150.99 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.439 1.496 . . . . 0.0 114.069 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.55 110.4 7.19 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 171.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.5 m120 -65.61 130.33 42.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 115.885 -2.007 . . . . 0.0 112.061 -171.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.655 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.426 1.9 t -127.62 150.08 33.14 Favored 'Isoleucine or valine' 0 C--N 1.362 1.145 0 C-N-CA 113.031 -3.468 . . . . 0.0 116.249 169.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.7 t -161.04 172.38 16.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.778 1.231 . . . . 0.0 108.139 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.9 p -71.24 146.7 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 17.4 t -80.47 155.77 26.89 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 122.861 0.464 . . . . 0.0 111.192 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -103.43 -4.01 24.66 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 121.959 0.104 . . . . 0.0 111.068 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -82.93 156.18 67.43 Favored Pre-proline 0 N--CA 1.455 -0.181 0 C-N-CA 123.038 0.535 . . . . 0.0 110.276 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -74.84 -37.75 2.01 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.89 2.394 . . . . 0.0 112.144 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.89 163.16 11.57 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.511 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.7 mt -82.3 138.76 18.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 45.8 mmm -102.2 123.65 42.56 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 122.67 0.388 . . . . 0.0 110.506 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -73.7 153.47 48.69 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.19 2.593 . . . . 0.0 109.374 174.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.8 -123.81 1.39 Allowed Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.907 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -72.49 163.85 27.35 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.914 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 470' ' ' SER . 97.5 p -151.21 176.22 11.41 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.123 0.969 . . . . 0.0 109.351 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -136.93 7.08 2.93 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.335 -0.228 . . . . 0.0 111.127 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.55 -172.71 55.14 Favored Glycine 0 CA--C 1.526 0.734 0 O-C-N 122.202 -0.311 . . . . 0.0 112.47 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 75.2 mt -144.92 170.09 16.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.761 1.224 . . . . 0.0 109.586 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -70.09 -28.81 65.71 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.001 -0.437 . . . . 0.0 111.129 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -120.62 9.71 10.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -142.05 164.3 26.86 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 91.8 p -94.51 -22.56 18.16 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.592 0.357 . . . . 0.0 111.94 -176.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.5 t -127.01 146.88 50.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.878 0.471 . . . . 0.0 110.328 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . 0.423 ' H ' ' HB2' ' A' ' 461' ' ' SER . 89.0 p -88.65 9.54 23.83 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.779 0.832 . . . . 0.0 110.838 176.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -141.34 150.7 42.81 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.002 1.321 . . . . 0.0 114.328 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -155.93 148.07 23.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.992 0.36 . . . . 0.0 111.099 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -100.74 146.35 27.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -140.38 1.45 1.77 Allowed 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 89.8 p -66.28 -19.35 65.79 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.337 0.655 . . . . 0.0 112.039 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -114.03 2.86 15.11 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.512 0.725 . . . . 0.0 111.152 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -76.15 150.03 37.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.976 0.417 . . . . 0.0 111.611 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -81.44 -11.88 59.1 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.538 0.735 . . . . 0.0 110.656 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -66.22 -18.12 65.16 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -63.33 131.1 47.19 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.718 0.407 . . . . 0.0 110.457 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.2 tpt85 -80.93 -33.77 33.83 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.318 62.9 m-85 -98.0 9.14 43.52 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 117.889 2.551 . . . . 0.0 117.889 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 28.2 m -75.53 -3.58 34.99 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.04 147.72 61.86 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -71.7 -24.77 21.29 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.269 2.646 . . . . 0.0 111.466 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -82.87 -25.78 32.21 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.003 0.365 . . . . 0.0 110.601 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -80.07 -43.94 20.93 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.143 -0.348 . . . . 0.0 110.185 173.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -58.76 -18.63 33.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.02 -19.24 44.31 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -124.05 8.13 8.62 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -65.13 154.11 38.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.135 0.425 . . . . 0.0 111.448 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -151.42 137.07 17.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 178.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.8 mm -141.55 140.57 31.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.058 0 C-N-CA 123.526 0.73 . . . . 0.0 109.39 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -149.42 169.28 21.23 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.07 0.948 . . . . 0.0 109.948 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -60.15 152.92 59.87 Favored Pre-proline 0 N--CA 1.455 -0.185 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.37 156.12 61.92 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.996 2.464 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 44.3 t -154.83 175.77 13.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.7 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -83.66 -4.86 58.95 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.283 -0.26 . . . . 0.0 110.423 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -94.01 138.2 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 176.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.45 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 82.9 mt -126.31 153.7 44.48 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.268 0.627 . . . . 0.0 109.855 175.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -124.0 131.1 53.52 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -123.93 158.41 32.05 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 -176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -143.75 150.59 38.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -174.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 50.93 57.09 7.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.748 1.219 . . . . 0.0 112.728 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.12 160.58 25.51 Favored Pre-proline 0 N--CA 1.454 -0.251 0 C-N-CA 123.594 0.758 . . . . 0.0 110.265 175.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.46 152.1 27.81 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.265 2.643 . . . . 0.0 112.535 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.57 -16.51 63.89 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.872 0.469 . . . . 0.0 111.934 -177.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -122.94 25.88 8.38 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.876 0.87 . . . . 0.0 110.751 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -64.61 -13.91 15.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.647 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.5 OUTLIER -54.81 -177.41 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -165.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.647 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.46 -39.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -169.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.0 mt-10 -59.74 -43.65 94.16 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 172.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.96 -28.78 21.25 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 122.181 2.264 . . . . 0.0 106.873 -174.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -66.98 -33.34 75.36 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -76.53 -42.19 44.03 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -73.2 -26.34 61.12 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 75.6 mt -76.9 -41.33 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.162 0.437 . . . . 0.0 110.902 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 89.8 m -68.34 -35.09 77.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.178 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -69.45 -38.49 77.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -71.1 -27.74 63.81 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.509 0.323 . . . . 0.0 111.533 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.8 mt -93.53 -4.1 51.64 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.8 0.44 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.07 32.56 58.4 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.943 -0.473 . . . . 0.0 112.626 175.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.6 m -127.03 164.68 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 117.554 0.677 . . . . 0.0 111.585 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.52 142.9 57.36 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -83.58 153.8 65.08 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.25 146.66 76.56 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 123.017 2.478 . . . . 0.0 110.729 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.1 t -85.01 -15.82 42.88 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.0 t -150.32 153.08 35.47 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.808 0.443 . . . . 0.0 109.878 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 72.8 t -141.67 145.3 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 123.39 0.676 . . . . 0.0 109.91 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -145.81 138.12 25.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.352 0.661 . . . . 0.0 109.365 176.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 18.4 t -141.77 140.16 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 C-N-CA 123.667 0.787 . . . . 0.0 110.393 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -155.36 169.08 25.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 -176.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.3 p -79.53 170.47 16.52 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.806 0.842 . . . . 0.0 111.485 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 82.68 -174.38 53.04 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.941 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 62.7 -19.44 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.151 1.78 . . . . 0.0 113.86 -177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 43.8 t -161.67 157.93 25.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 110.228 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -116.96 -7.77 11.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.505 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -88.14 -34.8 17.74 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 123.363 0.665 . . . . 0.0 112.237 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 4.0 m -160.59 170.68 20.38 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.016 0.526 . . . . 0.0 111.283 -173.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.4 t -79.89 165.5 22.61 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.44 0.696 . . . . 0.0 111.567 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.6 m -147.89 161.8 40.57 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.413 1.085 . . . . 0.0 109.588 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.56 -170.6 43.74 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.963 -178.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -119.16 159.96 23.01 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.943 0.897 . . . . 0.0 110.356 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.2 mt -141.46 159.79 41.49 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 108.94 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -150.26 149.22 29.86 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 117.782 0.264 . . . . 0.0 111.355 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . 0.45 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 13.0 m-90 -124.42 171.91 9.57 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 124.986 1.314 . . . . 0.0 112.48 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -74.48 -12.38 60.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.389 0.276 . . . . 0.0 110.478 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.5 t -157.51 156.06 31.37 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 121.707 -0.62 . . . . 0.0 111.135 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -23.24 63.45 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 122.256 -0.278 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 51.3 m -78.22 -25.29 46.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -78.09 -32.23 50.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.54 0.336 . . . . 0.0 110.708 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.07 -25.56 58.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.334 -0.228 . . . . 0.0 110.431 175.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 60.1 tp -74.66 -41.58 60.04 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.274 -0.266 . . . . 0.0 110.962 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.77 -35.74 75.16 Favored 'General case' 0 N--CA 1.456 -0.145 0 O-C-N 121.965 -0.459 . . . . 0.0 109.903 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.95 -23.57 55.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 177.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.84 -39.44 90.79 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.89 -37.35 88.08 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.339 27.7 m-85 -84.47 -4.59 59.02 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 118.85 2.907 . . . . 0.0 118.85 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 85.5 mt -122.15 -22.0 5.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.049 0.84 . . . . 0.0 113.09 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -70.85 139.17 50.77 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 119.369 0.986 . . . . 0.0 110.388 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 58.91 12.78 2.47 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.645 1.178 . . . . 0.0 112.968 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.268 36.6 t80 -71.25 140.8 50.52 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -72.2 137.8 47.14 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.156 -0.34 . . . . 0.0 111.704 -175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.9 mtm -83.41 145.28 29.08 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 122.356 0.263 . . . . 0.0 110.802 177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 60.4 pttt . . . . . 0 C--O 1.233 0.186 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.726 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.87 164.98 27.11 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.902 3.068 . . . . 0.0 111.96 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -130.0 142.3 50.65 Favored 'General case' 0 C--O 1.23 0.069 0 N-CA-C 102.618 -3.104 . . . . 0.0 102.618 173.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.262 0.7 OUTLIER -74.64 138.31 42.82 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.7 tt -89.59 147.1 24.12 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.34 158.53 43.88 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.574 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.93 169.36 23.67 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.232 0.539 . . . . 0.0 111.041 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 51.5 t -155.91 164.07 38.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.445 1.098 . . . . 0.0 109.377 -175.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -57.36 121.07 9.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 174.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 41.5 t -75.79 144.6 41.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -169.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 t -112.25 13.52 20.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.88 -1.054 . . . . 0.0 113.684 169.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.28 162.92 13.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.242 1.017 . . . . 0.0 111.909 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -87.35 -3.07 59.02 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.967 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -177.52 176.57 1.26 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.32 1.048 . . . . 0.0 110.081 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -137.19 23.3 3.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.657 0.783 . . . . 0.0 110.917 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.129 -1.415 . . . . 0.0 111.09 -177.195 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 N--CA 1.453 -0.903 0 N-CA-C 111.166 -0.359 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -151.93 156.4 40.0 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.233 0.613 . . . . 0.0 110.376 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.21 157.45 37.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.676 0.39 . . . . 0.0 110.836 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -83.35 6.69 19.02 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 30.0 t -154.28 145.05 16.11 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.119 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.0 Cg_exo -62.36 -7.39 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.911 3.074 . . . . 0.0 112.686 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.41 154.43 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -173.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.2 tt -132.36 154.55 49.64 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.76 1.624 . . . . 0.0 108.103 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 13.9 tpt -134.95 136.49 42.3 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.308 0.243 . . . . 0.0 110.949 -174.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -130.62 151.59 36.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -175.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -137.2 172.74 12.54 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.54 11.11 80.66 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.843 -0.421 . . . . 0.0 112.881 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.5 mt -77.97 28.04 0.18 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.802 0.801 . . . . 0.0 112.25 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.42 -39.17 91.8 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.61 148.69 51.56 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.094 0.473 . . . . 0.0 111.147 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.6 p -70.61 -6.72 38.84 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.887 0.875 . . . . 0.0 113.008 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -78.54 -13.45 59.82 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.61 0.364 . . . . 0.0 111.611 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 70.0 mmm -84.69 148.98 26.11 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -163.03 162.21 25.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 16.6 p -59.68 -32.31 70.37 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 122.112 -0.368 . . . . 0.0 111.267 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -73.29 -30.71 63.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 395' ' ' ARG . 1.0 OUTLIER -74.27 -51.67 14.62 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 12.5 m -65.03 -39.0 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.875 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.675 ' CE1' HG13 ' A' ' 406' ' ' VAL 0.358 1.9 m-85 -67.85 -51.89 43.04 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 175.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -58.08 -36.34 72.71 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.255 -173.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 28.5 t -60.4 -64.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.334 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.504 5.3 p90 -76.51 -5.82 49.17 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 118.226 2.676 . . . . 0.0 118.226 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.62 -32.42 53.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.998 0.519 . . . . 0.0 110.036 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -59.2 -17.73 30.25 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.008 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -89.87 -17.5 27.94 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.73 179.36 44.32 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 118.494 0.588 . . . . 0.0 112.941 -176.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -75.33 146.74 40.7 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -175.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.675 HG13 ' CE1' ' A' ' 397' ' ' PHE . 24.1 t -114.15 163.35 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.979 1.311 . . . . 0.0 113.206 -172.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.483 ' N ' HG12 ' A' ' 406' ' ' VAL . 64.1 mm-40 -132.87 -66.89 0.65 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.192 -0.432 . . . . 0.0 111.726 174.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -153.31 156.51 38.51 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.745 0.702 . . . . 0.0 112.833 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . 0.535 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.8 p -141.43 148.03 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 174.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -153.5 123.88 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.617 0.246 . . . . 0.0 111.312 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -74.76 162.37 28.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 66.4 mtm -135.11 126.67 28.8 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 121.347 0.594 . . . . 0.0 112.118 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -5.58 54.65 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 124.509 1.124 . . . . 0.0 111.801 176.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 91.6 p -77.96 -4.02 44.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.759 0.424 . . . . 0.0 111.208 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -138.49 158.51 70.35 Favored Pre-proline 0 CA--C 1.529 0.159 0 C-N-CA 124.492 1.117 . . . . 0.0 109.484 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.32 -13.68 40.93 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.149 2.566 . . . . 0.0 111.614 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.32 99.27 0.12 Allowed Glycine 0 C--N 1.336 0.534 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 175.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.94 156.76 35.1 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.814 0.446 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -155.95 146.28 21.68 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 111.219 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 81.4 mtp -88.61 147.84 24.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.1 t -142.13 118.5 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -102.34 134.17 46.06 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 70.0 mtp -153.71 173.91 15.21 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.472 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.58 116.96 7.38 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -72.25 -33.24 67.36 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -167.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.83 -87.35 0.02 OUTLIER Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -74.31 -24.42 59.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.93 -34.92 16.74 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.974 -176.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 69.9 t -84.84 -25.04 7.02 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 118.573 -1.251 . . . . 0.0 109.041 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -66.66 -54.29 24.72 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.913 0.324 . . . . 0.0 111.647 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -64.3 -37.21 86.7 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.52 -35.13 77.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.239 0.472 . . . . 0.0 110.786 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.67 -10.68 12.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.523 0.329 . . . . 0.0 110.919 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 58.6 m -96.76 -20.31 18.31 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -125.61 -31.48 2.97 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.483 HD23 HD22 ' A' ' 439' ' ' ASN . 90.8 mt -134.26 -7.26 2.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.333 1.424 . . . . 0.0 114.299 -169.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.1 p-10 -71.17 100.94 2.16 Favored 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 -170.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.2 m-80 76.92 21.23 1.18 Allowed 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 123.97 3.077 . . . . 0.0 112.156 -162.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . 0.483 HD22 HD23 ' A' ' 436' ' ' LEU . 55.7 t30 -84.76 159.44 20.47 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 169.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -75.85 138.8 41.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -160.25 145.58 14.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.566 0.746 . . . . 0.0 109.081 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 60.06 15.57 5.22 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.07 11.41 84.46 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -133.94 -161.44 1.14 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.608 1.563 . . . . 0.0 108.47 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.16 151.14 50.39 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 121.963 -0.461 . . . . 0.0 110.683 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -130.34 91.12 3.04 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.6 m120 -58.93 128.21 36.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 115.863 -2.018 . . . . 0.0 111.721 -173.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.42 1.9 t -128.21 150.47 33.98 Favored 'Isoleucine or valine' 0 C--N 1.367 1.348 0 C-N-CA 113.113 -3.435 . . . . 0.0 116.076 170.157 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 48.6 t -159.94 167.84 27.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.298 1.439 . . . . 0.0 108.618 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -70.74 148.93 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 21.4 t -85.01 158.13 20.56 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.783 0.433 . . . . 0.0 111.497 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -107.44 -1.33 21.57 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.386 0.275 . . . . 0.0 111.45 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -85.13 149.01 51.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.792 0.437 . . . . 0.0 110.621 175.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.47 -33.57 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.211 2.607 . . . . 0.0 112.542 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.07 157.79 11.71 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.064 0.393 . . . . 0.0 111.715 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 81.2 mt -83.39 145.23 8.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.4 mtp -114.75 126.98 27.26 Favored Pre-proline 0 CA--C 1.532 0.256 0 O-C-N 122.342 -0.224 . . . . 0.0 110.844 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.13 173.6 14.15 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 124.134 3.223 . . . . 0.0 110.286 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 136.63 -107.78 0.62 Allowed Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.034 -0.827 . . . . 0.0 111.034 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.37 158.34 35.96 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.326 0.65 . . . . 0.0 111.054 -177.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 40.6 t -161.1 163.81 31.15 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.8 0.84 . . . . 0.0 109.466 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -130.56 0.41 4.45 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.03 -177.3 54.37 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 122.934 0.302 . . . . 0.0 112.491 -178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.5 mt -143.7 157.75 44.17 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 124.343 1.057 . . . . 0.0 109.338 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 465' ' ' GLU . 10.5 pm0 -71.82 -10.22 59.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.779 0.431 . . . . 0.0 112.073 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -120.48 20.25 11.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.323 0.649 . . . . 0.0 110.237 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -168.35 -151.74 7.27 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.0 t -133.05 -16.1 2.52 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.8 p -127.06 146.82 50.23 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.374 0.669 . . . . 0.0 111.4 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 93.1 p -92.44 -0.11 57.39 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.862 0.465 . . . . 0.0 110.434 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -126.81 144.96 50.81 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -155.37 156.68 35.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.257 0.2 OUTLIER -136.69 142.74 43.15 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -129.24 12.33 6.03 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 32.2 t -64.04 -25.14 67.98 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.465 0.706 . . . . 0.0 112.013 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -114.0 3.84 15.49 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.351 0.661 . . . . 0.0 111.62 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 45.4 t -75.82 153.6 36.77 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 111.687 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 54.4 ttt180 -83.42 -14.48 52.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.259 0.624 . . . . 0.0 110.717 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -63.24 -22.29 66.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.121 0.568 . . . . 0.0 112.255 -174.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -58.03 130.83 48.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -68.88 -33.84 74.45 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -170.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.413 56.9 m-85 -98.0 17.35 18.53 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.1 t -61.58 -25.73 67.51 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -172.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.57 151.84 76.72 Favored Pre-proline 0 C--O 1.232 0.14 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -177.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.09 -15.66 39.77 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.006 2.471 . . . . 0.0 109.872 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.8 -32.73 60.0 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -80.6 -47.09 14.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 174.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.78 -21.43 65.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.94 -22.55 55.86 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.22 -0.3 . . . . 0.0 111.647 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -124.05 -1.81 8.24 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -60.25 153.93 21.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.425 0.557 . . . . 0.0 111.655 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -152.86 147.34 25.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.5 mm -135.82 147.55 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 C-N-CA 123.252 0.621 . . . . 0.0 109.578 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -156.56 160.54 39.56 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.019 0.528 . . . . 0.0 110.044 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -61.01 155.09 56.78 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.749 0.42 . . . . 0.0 109.999 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.68 146.67 89.13 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.099 2.533 . . . . 0.0 111.065 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 92.5 p -151.48 176.66 11.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.552 0.741 . . . . 0.0 109.627 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -83.71 -2.14 55.59 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.03 142.93 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 123.199 0.6 . . . . 0.0 112.124 175.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.2 tp -137.69 151.75 48.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -124.22 149.99 45.77 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.783 0.833 . . . . 0.0 109.149 -177.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -142.11 159.9 41.29 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.612 0.72 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -149.69 160.04 43.85 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 102.719 -3.067 . . . . 0.0 102.719 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 58.45 57.39 3.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.327 -0.233 . . . . 0.0 111.472 -174.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -123.17 148.51 54.9 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 122.589 0.356 . . . . 0.0 111.202 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.24 155.47 29.45 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.67 2.913 . . . . 0.0 112.794 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.16 -16.38 63.97 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.324 0.649 . . . . 0.0 111.724 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -120.33 20.95 11.85 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.69 0.796 . . . . 0.0 111.183 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.58 -13.91 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.82 -177.3 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -166.158 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -24.05 -40.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.6 mt-10 -58.53 -46.22 87.27 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.289 -1.338 . . . . 0.0 114.449 173.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -87.93 -27.96 21.8 Favored 'General case' 0 C--N 1.351 0.635 0 CA-C-N 122.653 2.479 . . . . 0.0 106.669 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -63.7 -38.07 89.72 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -75.6 -42.7 51.19 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -75.07 -20.91 59.29 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.132 -177.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -77.29 -39.92 28.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 118.268 0.486 . . . . 0.0 110.032 175.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.7 m -69.02 -31.39 70.17 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 122.137 -0.352 . . . . 0.0 110.838 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -72.7 -32.93 66.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.42 0.288 . . . . 0.0 110.692 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -71.74 -27.72 63.18 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.76 -5.96 37.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.818 0.281 . . . . 0.0 111.68 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.93 -7.83 8.91 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 123.678 0.656 . . . . 0.0 113.362 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.2 m -77.34 174.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 118.41 1.105 . . . . 0.0 112.784 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.73 164.52 6.07 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 123.295 0.638 . . . . 0.0 111.922 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -127.16 150.14 71.45 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.587 0.755 . . . . 0.0 109.281 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.11 154.68 69.92 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.095 2.53 . . . . 0.0 111.631 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.9 t -89.33 -17.11 29.56 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 17.3 t -155.48 155.27 33.17 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.523 0.329 . . . . 0.0 110.208 177.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.5 m -141.79 155.22 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -147.56 141.2 25.57 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.597 0.759 . . . . 0.0 109.473 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.33 141.91 29.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.302 0.641 . . . . 0.0 111.796 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -155.23 167.57 29.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -91.02 175.14 7.06 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.917 0.887 . . . . 0.0 110.785 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 95.26 177.07 37.55 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 123.591 0.615 . . . . 0.0 111.71 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 49.7 13.34 0.09 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.701 2.0 . . . . 0.0 114.432 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -160.85 157.65 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 123.797 0.839 . . . . 0.0 109.766 177.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -117.09 6.17 12.86 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -141.22 -10.62 0.96 Allowed 'General case' 0 C--N 1.341 0.198 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 45.2 t -154.31 163.85 39.5 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.463 0.574 . . . . 0.0 111.707 -170.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 60.1 p -90.11 173.63 8.07 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 111.349 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.5 m -145.72 165.8 27.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.595 1.158 . . . . 0.0 108.786 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.56 -174.27 46.06 Favored Glycine 0 CA--C 1.525 0.661 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.959 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.82 161.3 22.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.792 0.837 . . . . 0.0 110.299 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.1 mt -140.64 161.57 37.45 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.885 1.274 . . . . 0.0 108.784 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -148.05 149.76 32.68 Favored 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.936 0.346 . . . . 0.0 111.936 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -127.48 172.14 10.96 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.638 1.575 . . . . 0.0 112.333 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.21 -9.99 59.16 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.4 t -161.38 158.45 26.89 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.092 0.557 . . . . 0.0 110.339 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -73.52 -19.87 60.81 Favored 'General case' 0 CA--C 1.527 0.074 0 O-C-N 122.294 -0.254 . . . . 0.0 111.175 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 86.7 p -79.83 -25.48 40.78 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.92 0.327 . . . . 0.0 110.158 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -76.81 -35.85 57.33 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.323 0.249 . . . . 0.0 111.173 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.32 62.14 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 36.0 tp -73.89 -41.48 62.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.895 0.478 . . . . 0.0 110.12 178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -63.07 -47.07 84.49 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.061 0.457 . . . . 0.0 110.551 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -26.1 63.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 177.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.4 -38.9 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -63.78 -40.46 98.49 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.355 30.1 m-85 -91.13 -3.66 56.88 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 119.362 3.097 . . . . 0.0 119.362 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 74.5 mt -120.3 -4.86 9.92 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.498 1.045 . . . . 0.0 113.482 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -74.66 143.61 44.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.344 0.974 . . . . 0.0 108.54 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 58.07 19.28 5.87 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.591 0.757 . . . . 0.0 112.331 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -71.31 155.47 40.63 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -177.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -70.54 157.9 37.07 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.2 mtm -126.66 152.71 46.37 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.187 0.595 . . . . 0.0 111.917 173.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 169.061 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -83.57 169.25 12.35 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.616 2.877 . . . . 0.0 111.143 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -130.03 142.32 50.63 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 102.834 -3.024 . . . . 0.0 102.834 172.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -76.65 137.14 39.25 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 116.316 1.969 . . . . 0.0 116.316 -175.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.7 tt -87.42 150.03 24.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.437 1.095 . . . . 0.0 108.625 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -141.43 153.95 45.3 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.48 161.44 40.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.938 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.5 p -163.27 171.28 16.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.281 0.633 . . . . 0.0 111.626 -175.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -54.34 121.67 8.76 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.4 t -80.52 149.04 30.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -169.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 1.0 OUTLIER -111.68 9.22 20.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 169.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.41 168.75 15.4 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.261 1.025 . . . . 0.0 111.801 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -95.47 -3.12 47.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -175.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.74 178.03 4.24 Favored 'General case' 0 C--N 1.338 0.086 0 C-N-CA 123.346 0.659 . . . . 0.0 110.216 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.2 31.49 1.37 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.776 0.43 . . . . 0.0 111.768 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.252 1.192 0 CA-C-O 117.779 -1.105 . . . . 0.0 110.942 -178.879 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo . . . . . 0 N--CA 1.454 -0.821 0 CA-C-O 120.63 0.179 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -78.2 155.41 30.38 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.952 0.501 . . . . 0.0 110.017 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -71.93 155.47 40.32 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.808 0.337 . . . . 0.0 110.714 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -84.59 7.82 18.86 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 38.3 t -151.6 143.49 16.09 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 122.051 -0.406 . . . . 0.0 110.947 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 31.3 Cg_exo -63.12 -1.39 2.86 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.292 3.328 . . . . 0.0 113.976 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.4 p -143.01 156.24 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-O 121.809 0.814 . . . . 0.0 109.202 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.54 164.17 24.37 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.078 1.751 . . . . 0.0 107.825 -177.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.1 ttt -144.13 138.64 28.32 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.816 0.735 . . . . 0.0 111.855 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.7 154.54 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 C-N-CA 124.136 0.974 . . . . 0.0 108.588 -175.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -141.89 171.8 13.56 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.94 10.63 75.11 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 112.057 -0.417 . . . . 0.0 112.057 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 53.8 mt -79.03 26.51 0.25 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.761 0.78 . . . . 0.0 111.879 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -62.9 -35.57 80.49 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.455 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.7 pm0 -67.19 150.64 48.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.2 p -69.81 -7.17 37.63 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 123.687 0.795 . . . . 0.0 112.705 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -79.12 -7.39 58.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.367 0.667 . . . . 0.0 112.311 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 69.1 mmm -91.27 151.9 20.71 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.632 0.651 . . . . 0.0 111.259 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -159.54 155.51 26.49 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.574 0.75 . . . . 0.0 109.754 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 10.8 p -60.24 -38.36 83.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.29 -30.76 63.62 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -75.87 -43.28 46.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.656 0.382 . . . . 0.0 111.082 -177.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.488 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 1.1 m-85 -62.39 -53.39 55.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.099 2.259 . . . . 0.0 117.099 177.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -60.47 -32.49 71.45 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.351 -1.34 . . . . 0.0 109.787 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 11.0 t -60.92 -62.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.4 OUTLIER -76.54 -8.11 56.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 175.822 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.9 t -73.11 -29.66 63.08 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.917 -0.49 . . . . 0.0 109.951 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . 0.429 HD11 ' CE2' ' A' ' 403' ' ' TYR . 2.0 pp -60.18 -16.26 31.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.074 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . 0.429 ' CE2' HD11 ' A' ' 402' ' ' LEU . 52.2 m-85 -94.87 -6.86 41.77 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.104 2.261 . . . . 0.0 117.104 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.2 175.49 32.28 Favored Glycine 0 CA--C 1.527 0.844 0 CA-C-N 118.35 0.523 . . . . 0.0 112.85 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -70.35 137.31 50.47 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 111.719 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.488 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 15.1 m -114.03 165.31 9.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 124.959 1.304 . . . . 0.0 109.397 -176.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -139.39 -54.65 0.57 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -151.39 152.46 33.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.792 1.178 . . . . 0.0 112.972 -176.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 13.9 p -141.5 145.12 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 123.424 0.69 . . . . 0.0 109.914 176.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -153.6 128.23 9.37 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.872 0.469 . . . . 0.0 110.673 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -80.5 147.83 30.7 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 117.08 2.252 . . . . 0.0 117.08 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.1 mmt -83.3 128.55 34.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.431 0.692 . . . . 0.0 111.409 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . 0.539 ' HE3' ' CD1' ' A' ' 462' ' ' TYR . 36.6 mttp -79.3 -30.14 42.77 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 122.98 0.512 . . . . 0.0 111.108 173.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 28.4 t -79.77 -19.46 48.6 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.925 0.89 . . . . 0.0 112.956 -174.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -108.84 154.15 41.98 Favored Pre-proline 0 N--CA 1.455 -0.191 0 C-N-CA 123.068 0.547 . . . . 0.0 110.179 -175.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -67.96 -17.54 46.34 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.109 2.54 . . . . 0.0 111.293 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.45 103.68 0.17 Allowed Glycine 0 C--N 1.336 0.576 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -163.74 160.74 22.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.49 0.716 . . . . 0.0 109.385 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.47 143.11 16.06 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 79.4 mtp -81.18 149.55 29.05 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.3 t -142.68 102.05 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -84.51 134.38 34.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 75.0 mtp -153.6 171.46 18.73 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 123.723 0.809 . . . . 0.0 109.716 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.49 114.73 6.39 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 169.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -72.43 -33.87 67.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -166.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -52.49 -89.16 0.01 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.251 55.5 m-85 -77.93 -20.66 52.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 117.389 2.366 . . . . 0.0 117.389 -176.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -89.0 -35.76 16.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 119.021 -1.071 . . . . 0.0 111.673 -176.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.6 t -84.82 -26.67 6.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.221 0 C-N-CA 118.722 -1.191 . . . . 0.0 108.24 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -62.14 -62.88 1.46 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 173.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -65.83 -29.14 69.56 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.34 -36.13 78.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.736 0.698 . . . . 0.0 110.401 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 -11.49 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.907 0.483 . . . . 0.0 110.793 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.8 m -94.53 -21.85 18.6 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -130.13 -19.26 3.21 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -169.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.72 -12.33 2.3 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.669 1.577 . . . . 0.0 114.573 -175.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.51 100.98 2.35 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -169.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.1 m-80 76.91 22.05 1.1 Allowed 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 124.05 3.114 . . . . 0.0 113.21 -162.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.84 159.09 25.17 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.593 -0.692 . . . . 0.0 110.117 167.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.26 137.98 41.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 15.8 ttt -157.77 141.18 15.41 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.256 0.623 . . . . 0.0 109.665 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 58.55 16.65 4.39 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 81.63 11.3 83.18 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -132.66 -161.83 1.17 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.782 1.633 . . . . 0.0 108.373 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.78 149.23 49.06 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.886 -0.509 . . . . 0.0 110.8 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -126.39 82.36 2.07 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.446 0.698 . . . . 0.0 109.417 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.1 m120 -54.41 127.95 29.65 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 115.497 -2.192 . . . . 0.0 112.678 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.0 t -127.77 149.17 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 113.464 -3.294 . . . . 0.0 116.519 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.43 168.55 24.92 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.281 1.432 . . . . 0.0 107.653 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.89 150.07 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.1 t -88.62 157.98 18.4 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.133 0.573 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -105.51 -3.47 22.41 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.446 0.298 . . . . 0.0 111.182 178.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -75.49 156.58 85.12 Favored Pre-proline 0 CA--C 1.53 0.207 0 C-N-CA 123.259 0.624 . . . . 0.0 110.467 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.85 -35.47 0.99 Allowed 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.897 2.398 . . . . 0.0 112.193 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.57 167.94 9.47 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.393 0.677 . . . . 0.0 110.399 -175.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 65.5 mt -93.89 136.43 25.49 Favored 'Isoleucine or valine' 0 C--O 1.23 0.063 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 69.7 mmm -85.27 130.66 50.91 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-O 119.719 -0.182 . . . . 0.0 110.685 175.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -77.77 27.82 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.807 3.671 . . . . 0.0 111.341 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -74.54 -143.41 0.86 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.955 0.788 . . . . 0.0 113.535 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -72.53 166.95 21.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.727 0.811 . . . . 0.0 111.366 -174.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -146.11 175.46 10.46 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.928 0.891 . . . . 0.0 110.8 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.539 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 32.3 p90 -141.28 -178.4 5.58 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.734 0.813 . . . . 0.0 108.847 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.82 177.18 45.01 Favored Glycine 0 CA--C 1.528 0.867 0 O-C-N 122.031 -0.418 . . . . 0.0 113.02 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 28.0 mt -140.94 168.61 19.37 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 124.24 1.016 . . . . 0.0 109.745 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -71.78 -31.22 66.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.325 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -120.57 18.47 12.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.768 0.427 . . . . 0.0 110.442 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.28 172.99 42.43 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.495 -0.753 . . . . 0.0 112.444 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 95.0 p -99.77 -16.61 18.04 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.99 136.97 52.98 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.25 0.477 . . . . 0.0 111.013 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 94.8 p -83.63 -0.5 50.84 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.113 0.965 . . . . 0.0 111.634 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.265 4.0 t80 -131.24 149.16 52.69 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -155.27 150.47 26.96 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -177.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.285 0.3 OUTLIER -129.89 140.94 50.88 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 178.149 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.48 7.52 10.1 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 39.3 t -65.34 -19.62 66.04 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.983 0.513 . . . . 0.0 111.764 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -113.91 2.26 15.01 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.126 0.57 . . . . 0.0 111.539 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.1 t -80.74 151.96 28.58 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.67 0.388 . . . . 0.0 111.349 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -81.64 -13.41 57.97 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.705 0.402 . . . . 0.0 111.191 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -59.52 -23.53 62.89 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -57.35 113.1 1.61 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.25 0.62 . . . . 0.0 109.775 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -75.32 -29.73 60.11 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.31 64.7 m-85 -98.0 15.03 25.31 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 43.8 t -71.34 -18.36 62.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -132.65 151.36 78.01 Favored Pre-proline 0 C--O 1.233 0.216 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.26 -32.51 62.03 Favored 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.345 2.697 . . . . 0.0 112.667 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -78.68 -27.33 45.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.115 0.416 . . . . 0.0 110.496 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -74.44 -41.13 61.37 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 174.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -63.43 -17.06 62.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.35 -0.218 . . . . 0.0 111.386 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -87.16 -10.54 52.43 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -124.02 -10.17 7.66 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -63.83 155.67 29.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -152.61 146.26 25.05 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 44.7 mm -123.21 149.32 26.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 C-N-CA 123.505 0.722 . . . . 0.0 109.516 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -156.02 155.95 33.58 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.823 0.449 . . . . 0.0 109.852 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -59.8 156.94 31.67 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.917 0.487 . . . . 0.0 109.906 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -62.91 142.67 89.25 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.182 1.922 . . . . 0.0 108.905 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.6 t -154.5 167.07 31.28 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.915 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -83.68 -2.54 56.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.802 0.441 . . . . 0.0 110.718 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.33 140.13 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.503 0.721 . . . . 0.0 112.403 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.9 mt -128.85 156.47 43.59 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.065 0.546 . . . . 0.0 110.118 176.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -115.65 150.23 37.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -137.46 154.98 49.82 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -151.57 166.83 29.97 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 102.959 -2.978 . . . . 0.0 102.959 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 56.55 57.53 4.78 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.003 -0.436 . . . . 0.0 111.663 -174.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -133.0 148.92 71.33 Favored Pre-proline 0 N--CA 1.454 -0.248 0 C-N-CA 122.427 0.291 . . . . 0.0 110.61 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.42 161.06 47.38 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.003 2.468 . . . . 0.0 110.917 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.61 -16.38 63.83 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.485 0.314 . . . . 0.0 111.008 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -100.44 12.18 37.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.404 0.682 . . . . 0.0 111.532 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.33 -18.22 23.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.706 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.1 m -55.07 -177.27 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.811 -1.09 . . . . 0.0 113.686 -166.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.706 ' H ' HG22 ' A' ' 510' ' ' THR . 23.4 pt-20 -23.09 -41.18 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -169.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.7 mt-10 -57.86 -47.22 83.35 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 173.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -88.04 -27.91 21.7 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 122.356 2.343 . . . . 0.0 106.296 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.33 -37.27 86.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -75.27 -42.23 55.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.65 -24.22 49.49 Favored 'General case' 0 CA--C 1.526 0.024 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.222 -177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.04 -41.7 52.45 Favored 'Isoleucine or valine' 0 C--N 1.337 0.052 0 CA-C-N 118.864 0.756 . . . . 0.0 109.984 176.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 99.7 m -65.98 -26.99 67.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.056 -0.403 . . . . 0.0 110.853 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -70.17 -41.31 73.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -71.35 -24.46 62.1 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -89.24 -5.96 57.21 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.313 0.245 . . . . 0.0 111.212 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 69.19 -7.45 3.35 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 123.702 0.668 . . . . 0.0 113.867 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.4 m -83.9 172.83 1.0 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-N 118.459 1.129 . . . . 0.0 113.33 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.8 152.05 32.53 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.292 1.037 . . . . 0.0 113.077 -174.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 47.3 mtm105 -95.59 149.92 36.75 Favored Pre-proline 0 CA--C 1.529 0.141 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.828 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -69.74 150.29 68.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.137 2.558 . . . . 0.0 110.658 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -92.19 -14.11 29.55 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.6 t -152.58 155.52 37.53 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.358 0.263 . . . . 0.0 110.716 176.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 61.0 t -145.3 145.68 20.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 123.688 0.795 . . . . 0.0 111.31 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -147.36 142.34 26.98 Favored 'General case' 0 CA--C 1.526 0.056 0 C-N-CA 123.894 0.877 . . . . 0.0 109.334 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.69 143.03 31.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 122.981 0.513 . . . . 0.0 111.218 -176.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.1 p90 -155.67 -178.31 7.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 69.9 m -131.42 177.69 7.3 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 110.858 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.95 -5.78 59.76 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.792 0.711 . . . . 0.0 112.689 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -93.22 -20.34 20.54 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-N 117.886 0.843 . . . . 0.0 111.167 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 36.9 t -164.45 155.27 15.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.23 0.612 . . . . 0.0 110.432 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.98 -7.93 31.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.463 0.305 . . . . 0.0 110.517 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -89.23 -31.52 17.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.5 p -160.83 168.53 24.52 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.458 0.646 . . . . 0.0 112.287 -172.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 29.8 t -81.36 167.22 19.71 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.611 1.164 . . . . 0.0 111.379 178.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -146.72 159.74 43.1 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 124.373 1.069 . . . . 0.0 109.518 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.99 -173.82 45.7 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.84 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -119.27 159.76 23.48 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.413 0.685 . . . . 0.0 110.693 -177.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.7 mt -140.61 159.26 42.58 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.081 1.352 . . . . 0.0 108.414 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.99 149.1 29.18 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.979 -0.451 . . . . 0.0 111.183 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -124.04 171.0 10.1 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 125.027 1.331 . . . . 0.0 112.479 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -73.63 -12.66 60.81 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.803 0.441 . . . . 0.0 111.487 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.7 t -157.19 160.15 38.43 Favored 'General case' 0 C--N 1.339 0.115 0 O-C-N 121.687 -0.633 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.84 -29.89 68.31 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.201 0.2 . . . . 0.0 110.822 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 89.7 p -76.4 -26.01 55.14 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -74.85 -35.42 62.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.336 0.255 . . . . 0.0 110.932 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.04 -37.18 66.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.17 -37.66 78.3 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.236 -0.29 . . . . 0.0 110.247 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -62.0 -45.71 92.42 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.093 0.473 . . . . 0.0 110.264 176.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.6 m -69.9 -28.18 65.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.09 -35.7 81.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.14 -44.82 90.36 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.464 -0.631 . . . . 0.0 111.888 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -89.65 -24.6 21.6 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.33 -18.62 20.63 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -173.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.38 152.36 39.56 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.621 -0.674 . . . . 0.0 110.428 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.49 17.28 4.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.023 1.329 . . . . 0.0 113.182 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -69.75 139.3 53.31 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -75.85 138.9 41.41 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.863 -0.523 . . . . 0.0 111.945 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.3 mtm -83.49 152.66 24.82 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.125 0.488 . . . . 0.0 111.624 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.226 0 C-N-CA 124.175 0.99 . . . . 0.0 113.062 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.5 p90 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 159.77 52.18 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.601 2.201 . . . . 0.0 111.348 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.39 142.29 50.84 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 102.542 -3.133 . . . . 0.0 102.542 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.276 0.7 OUTLIER -78.15 138.53 38.76 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -176.029 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.47 150.79 25.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.977 1.311 . . . . 0.0 108.203 172.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.06 152.78 46.47 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.986 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 10.8 mt -132.27 164.91 25.37 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.822 0.849 . . . . 0.0 111.144 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 47.6 t -159.17 154.42 25.42 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.742 0.817 . . . . 0.0 109.21 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -59.93 117.06 4.61 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 174.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.3 t -73.0 146.95 45.6 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -169.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -112.32 10.82 19.99 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 169.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.3 162.54 17.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.619 0.768 . . . . 0.0 111.321 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -86.17 -3.8 59.04 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.727 -175.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -176.24 178.07 1.44 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.674 1.19 . . . . 0.0 109.576 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -133.23 16.62 4.1 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.866 0.467 . . . . 0.0 111.682 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.261 179.718 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo . . . . . 0 N--CA 1.455 -0.754 0 N-CA-C 111.598 -0.193 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -155.9 153.68 30.04 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.027 0.442 . . . . 0.0 111.09 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.22 163.4 25.81 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.142 0.577 . . . . 0.0 111.185 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -74.09 -7.11 51.37 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.6 t -159.05 148.26 14.55 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.495 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.61 -14.56 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.349 2.7 . . . . 0.0 110.737 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.61 149.84 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -137.24 152.95 50.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.792 1.237 . . . . 0.0 108.225 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -133.96 133.44 41.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.398 -0.189 . . . . 0.0 110.512 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -129.91 152.04 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.086 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -140.74 173.13 11.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.72 10.71 78.69 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.437 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.6 mt -80.69 25.13 0.44 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.464 0.705 . . . . 0.0 112.201 -178.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -65.38 -39.87 92.78 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -175.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.6 pm0 -67.28 149.66 50.08 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.133 0.492 . . . . 0.0 111.143 -178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 88.0 p -68.26 -8.63 41.07 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -77.71 -20.37 53.67 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 118.116 0.416 . . . . 0.0 111.182 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 64.9 mmm -82.06 147.87 28.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 122.178 -0.326 . . . . 0.0 110.252 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.07 155.78 25.8 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -60.71 -30.5 70.0 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -71.81 -40.03 69.44 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 61.0 mtt85 -76.05 -41.12 51.72 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 -175.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.58 -43.66 77.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -176.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -76.83 -29.54 55.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.429 -0.796 . . . . 0.0 109.198 -169.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -78.84 -30.21 45.08 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 119.991 1.269 . . . . 0.0 110.0 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -54.77 29.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.557 2.4 p90 -76.72 -7.34 55.17 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 172.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.7 t -69.28 -26.39 64.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 78.8 mt -54.4 -24.36 19.48 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -92.94 -11.07 34.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -173.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 170.68 176.87 40.32 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 118.205 0.457 . . . . 0.0 112.199 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -68.61 136.28 52.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.853 0.359 . . . . 0.0 111.683 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.06 165.52 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -119.97 -70.96 0.76 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.449 0.3 . . . . 0.0 111.238 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -154.44 170.68 20.81 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 9.2 p -146.03 149.37 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.369 1.068 . . . . 0.0 110.513 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -155.8 137.86 14.58 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.353 0.661 . . . . 0.0 111.075 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.4 m-85 -88.23 156.53 19.17 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 21.9 mmt -98.38 118.86 36.0 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 122.879 0.472 . . . . 0.0 111.882 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -14.42 59.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.148 0.179 . . . . 0.0 110.686 169.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 98.9 p -84.23 1.3 45.25 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.752 0.821 . . . . 0.0 112.377 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -139.38 155.66 72.03 Favored Pre-proline 0 CA--C 1.528 0.115 0 C-N-CA 123.665 0.786 . . . . 0.0 110.134 -177.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -68.34 -16.08 43.15 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.174 2.583 . . . . 0.0 111.647 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.77 93.77 0.09 OUTLIER Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.41 161.55 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.467 0.707 . . . . 0.0 109.329 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.49 151.25 25.91 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.129 0.49 . . . . 0.0 111.958 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 36.8 ttm -96.11 147.29 23.88 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.6 t -141.17 152.46 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -138.56 133.69 32.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 42.6 mtp -152.36 174.17 14.16 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.346 1.058 . . . . 0.0 109.053 -171.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.85 124.25 21.97 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -72.53 -32.26 65.96 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.744 -1.222 . . . . 0.0 114.164 -166.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.07 -90.84 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 O-C-N 124.559 1.162 . . . . 0.0 110.775 -176.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.296 64.7 m-85 -75.85 -20.24 58.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.2 -33.99 15.98 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 118.569 -1.253 . . . . 0.0 111.371 -175.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.6 t -86.97 -26.96 5.89 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 C-N-CA 118.238 -1.385 . . . . 0.0 109.057 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -67.5 -51.37 52.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.651 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -65.49 -35.83 82.06 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.965 -0.46 . . . . 0.0 112.111 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.29 83.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.604 0.638 . . . . 0.0 110.417 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.5 mt -77.13 -14.15 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 122.848 0.459 . . . . 0.0 110.899 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 15.5 m -94.7 -19.78 20.11 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 114.452 1.279 . . . . 0.0 114.452 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -126.07 -27.99 3.21 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.9 mt -134.38 -8.94 2.55 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -172.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.635 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -70.27 105.32 2.94 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -168.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.3 m-80 75.15 22.08 1.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 116.788 -3.695 . . . . 0.0 115.055 -164.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -77.36 161.45 28.03 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.307 -0.871 . . . . 0.0 109.707 167.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -79.62 138.37 37.4 Favored 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 177.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.2 ttt -159.51 136.95 9.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.289 0.636 . . . . 0.0 110.174 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.389 52.0 m-85 57.32 26.65 12.66 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.02 9.79 86.69 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.261 -0.735 . . . . 0.0 111.261 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -135.84 -164.67 1.58 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.019 1.328 . . . . 0.0 108.779 -178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.46 147.22 52.13 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.698 0.285 . . . . 0.0 111.33 -176.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.5 ptm -118.57 75.6 1.03 Allowed 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 124.477 1.111 . . . . 0.0 109.171 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.3 m120 -53.7 127.19 24.71 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 115.979 -1.963 . . . . 0.0 112.265 -173.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.635 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.2 t -126.71 152.06 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 113.537 -3.265 . . . . 0.0 115.877 169.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 43.2 t -160.74 165.74 29.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.523 1.529 . . . . 0.0 108.324 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.14 147.93 11.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 O-C-N 121.56 -0.713 . . . . 0.0 112.56 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.4 t -88.14 157.72 18.75 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 122.827 0.451 . . . . 0.0 111.35 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -97.55 -5.66 35.26 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.087 0.155 . . . . 0.0 110.652 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -77.84 152.57 80.2 Favored Pre-proline 0 N--CA 1.456 -0.153 0 C-N-CA 123.546 0.739 . . . . 0.0 111.029 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.56 -36.06 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.363 2.709 . . . . 0.0 112.139 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.99 159.69 9.5 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.358 0.663 . . . . 0.0 110.707 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.23 132.41 32.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 37.0 mmm -100.33 126.24 36.76 Favored Pre-proline 0 N--CA 1.454 -0.24 0 C-N-CA 122.454 0.301 . . . . 0.0 110.707 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.62 153.79 44.03 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.186 2.591 . . . . 0.0 109.102 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 167.81 -127.8 1.62 Allowed Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.86 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -72.45 172.95 9.51 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.1 p -156.36 172.3 18.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.044 0.538 . . . . 0.0 110.215 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -137.16 4.44 2.7 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.0 -176.2 53.93 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 56.0 mt -145.65 168.76 19.9 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.053 0.941 . . . . 0.0 109.916 -178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.4 pm0 -65.3 -31.38 72.49 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.065 0.546 . . . . 0.0 110.364 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -120.5 10.02 11.04 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.47 172.82 30.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.739 -0.545 . . . . 0.0 111.739 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 92.0 p -101.72 -15.03 17.11 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 122.89 0.476 . . . . 0.0 111.997 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.11 145.69 50.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.864 0.465 . . . . 0.0 110.171 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 78.6 p -85.49 10.4 13.1 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.396 0.678 . . . . 0.0 111.301 177.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -138.18 149.9 46.26 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.29 150.98 30.35 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 120.801 0.334 . . . . 0.0 110.485 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -124.09 138.37 54.44 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.156 0.983 . . . . 0.0 113.577 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.23 2.53 5.18 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 95.9 p -66.11 -15.91 63.5 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.123 0.569 . . . . 0.0 112.158 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -113.98 -0.38 14.1 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.05 0.54 . . . . 0.0 111.369 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 68.6 m -79.84 150.83 30.54 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.599 0.36 . . . . 0.0 111.522 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -79.47 -12.56 59.88 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.987 0.515 . . . . 0.0 111.193 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.18 -18.99 62.62 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -176.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -61.75 115.04 3.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -73.06 -31.52 64.45 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.447 0.299 . . . . 0.0 111.59 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.29 61.1 m-85 -97.93 17.4 18.31 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 42.6 t -64.43 -20.9 66.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 0.8 OUTLIER -137.86 151.39 70.28 Favored Pre-proline 0 C--O 1.231 0.129 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -178.386 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.3 Cg_endo -70.55 -23.59 27.01 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.111 2.541 . . . . 0.0 111.923 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -80.13 -20.15 45.61 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.255 0.48 . . . . 0.0 110.705 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -85.73 -39.7 16.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 172.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.96 64.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.761 0.424 . . . . 0.0 111.996 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.27 -21.36 53.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -124.08 7.74 8.59 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.03 156.63 38.32 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.453 0.57 . . . . 0.0 111.913 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -118.6 146.47 44.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.553 0.741 . . . . 0.0 110.728 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.3 mm -143.57 138.29 25.64 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.21 159.3 35.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -58.81 154.91 34.24 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -65.16 146.57 87.04 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.32 2.013 . . . . 0.0 109.073 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -155.95 170.95 20.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.309 0.244 . . . . 0.0 110.636 -173.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -83.7 -1.19 53.56 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.569 0.348 . . . . 0.0 111.034 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.77 137.57 29.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.5 mt -123.32 161.48 24.58 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.232 0.613 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -130.17 143.76 50.97 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.736 1.214 . . . . 0.0 108.316 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.86 163.24 30.69 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.445 0.64 . . . . 0.0 112.067 -177.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -149.31 162.53 39.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 57.1 57.36 4.61 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.736 0.414 . . . . 0.0 111.727 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -121.64 151.27 56.82 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 122.686 0.394 . . . . 0.0 111.989 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.84 152.61 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.585 2.857 . . . . 0.0 112.921 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.61 -16.43 63.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.173 0.589 . . . . 0.0 111.444 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -123.05 25.62 8.44 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.394 0.677 . . . . 0.0 110.696 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.79 -12.59 14.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.657 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.91 -177.31 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.865 -1.065 . . . . 0.0 113.854 -165.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.657 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -26.46 -37.27 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -169.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.3 mt-10 -58.22 -47.38 83.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 117.07 -1.443 . . . . 0.0 114.559 171.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -88.19 -26.7 22.26 Favored 'General case' 0 C--N 1.353 0.718 0 CA-C-N 122.732 2.514 . . . . 0.0 107.113 -173.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -67.63 -34.49 77.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.503 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -75.2 -42.86 54.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -76.19 -21.34 56.58 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.802 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.96 -40.6 26.86 Favored 'Isoleucine or valine' 0 C--N 1.339 0.113 0 CA-C-N 118.423 0.556 . . . . 0.0 109.954 175.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 87.7 m -68.4 -34.59 76.31 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.958 -0.464 . . . . 0.0 110.933 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.16 -38.1 84.88 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -70.54 -28.39 64.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 122.114 -0.366 . . . . 0.0 111.032 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -92.51 -4.12 54.07 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.263 0.625 . . . . 0.0 111.519 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.58 -2.0 59.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.15 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.0 t -77.1 153.55 5.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 118.072 0.936 . . . . 0.0 112.182 178.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -68.36 151.68 46.52 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.399 . . . . 0.0 110.294 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.9 ptt85 -78.07 156.14 79.56 Favored Pre-proline 0 CA--C 1.53 0.2 0 C-N-CA 122.685 0.394 . . . . 0.0 110.365 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.06 154.29 72.93 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.111 2.541 . . . . 0.0 110.386 173.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.3 t -85.39 -17.28 37.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.1 t -156.97 152.72 27.0 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.558 0.343 . . . . 0.0 110.173 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.1 m -143.44 154.73 16.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 123.719 0.808 . . . . 0.0 112.35 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -150.75 144.33 25.05 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.181 0.592 . . . . 0.0 109.973 176.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -138.08 150.73 24.85 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 C-N-CA 123.398 0.679 . . . . 0.0 112.218 177.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -152.83 174.84 13.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.7 t -142.96 168.91 18.59 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.556 0.742 . . . . 0.0 109.624 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 115.15 -16.47 17.74 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 123.857 0.741 . . . . 0.0 111.985 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -80.91 -26.48 36.74 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 117.795 0.797 . . . . 0.0 111.131 175.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.2 t -163.9 157.35 18.58 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.747 0.819 . . . . 0.0 109.686 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -96.99 -6.89 34.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.539 0.336 . . . . 0.0 110.532 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -78.18 -41.54 34.33 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 32.5 t -161.13 163.56 31.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -170.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -90.36 167.32 12.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.096 0.958 . . . . 0.0 111.702 -177.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.3 m -145.44 165.66 27.91 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 124.996 1.318 . . . . 0.0 108.748 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.69 -170.77 43.92 Favored Glycine 0 CA--C 1.525 0.701 0 C-N-CA 120.554 -0.832 . . . . 0.0 113.322 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.03 159.84 26.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.036 0.934 . . . . 0.0 110.228 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.51 156.91 45.7 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 124.588 1.155 . . . . 0.0 109.085 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -148.18 149.38 31.87 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 117.925 0.33 . . . . 0.0 111.664 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.0 m-90 -126.81 172.53 10.3 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 124.828 1.251 . . . . 0.0 112.152 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -76.13 -9.59 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.666 0.386 . . . . 0.0 110.556 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.9 t -158.4 158.93 35.15 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.623 -0.673 . . . . 0.0 111.669 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -69.45 -24.9 63.87 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 122.368 0.267 . . . . 0.0 110.502 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 49.2 m -77.91 -27.49 49.53 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -74.31 -32.15 62.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -77.83 -25.91 49.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.7 tp -77.38 -37.16 52.66 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.199 0.199 . . . . 0.0 111.317 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -75.61 -38.54 58.92 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.591 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.264 0.2 OUTLIER -71.6 -22.28 61.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 12.1 tp -67.91 -37.44 81.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 170.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.11 -30.46 76.93 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.315 11.5 m-85 -101.32 -2.57 30.72 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 84.6 mt -125.05 -3.63 7.56 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.287 0.948 . . . . 0.0 113.29 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -79.88 139.58 37.08 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.739 1.154 . . . . 0.0 109.586 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 56.74 19.37 4.32 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 175.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -77.86 149.96 34.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 104.103 -2.555 . . . . 0.0 104.103 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -78.34 143.38 36.96 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.719 0.408 . . . . 0.0 111.992 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.1 mtm -83.57 152.65 24.75 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 111.259 175.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.138 0.975 . . . . 0.0 111.295 177.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.254 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -77.58 164.22 28.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 123.751 2.967 . . . . 0.0 111.675 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -129.93 142.29 50.67 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 172.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.02 141.96 32.76 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -82.3 146.1 29.61 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 172.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.14 148.48 49.76 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 117.829 0.286 . . . . 0.0 110.237 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.3 pp -154.99 165.46 36.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.181 0.515 . . . . 0.0 111.811 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 31.3 p -159.8 174.42 14.51 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.971 0.908 . . . . 0.0 109.887 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -61.04 126.43 27.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.4 t -84.29 156.09 22.11 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -172.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -122.08 11.78 10.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.317 1.047 . . . . 0.0 113.604 170.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.58 162.92 14.59 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.087 0.955 . . . . 0.0 111.659 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -85.73 -3.23 58.84 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.65 178.21 3.18 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.027 0.931 . . . . 0.0 109.359 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -132.41 16.43 4.47 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.987 0.515 . . . . 0.0 111.465 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.614 -1.184 . . . . 0.0 110.492 -179.861 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo . . . . . 0 N--CA 1.456 -0.727 0 N-CA-C 110.816 -0.494 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -146.33 158.32 43.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.819 0.448 . . . . 0.0 110.539 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.41 160.65 31.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.623 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -78.95 -3.43 44.89 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.379 0.672 . . . . 0.0 110.576 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -155.12 148.64 18.61 Favored Pre-proline 0 C--O 1.233 0.21 0 O-C-N 121.726 -0.609 . . . . 0.0 112.058 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -61.33 -5.84 5.89 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 124.246 3.297 . . . . 0.0 113.029 172.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 153.33 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.091 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.7 tt -128.07 154.49 45.64 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.655 1.582 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.9 tpt -137.4 133.55 34.9 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 117.847 0.294 . . . . 0.0 110.971 -175.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.54 153.44 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -146.12 170.48 16.61 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 87.72 6.94 75.83 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.669 -0.517 . . . . 0.0 113.07 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.05 45.28 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.106 0.962 . . . . 0.0 111.372 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -82.04 -13.47 57.29 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -174.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -83.76 147.14 27.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.672 0.389 . . . . 0.0 110.176 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 91.1 p -72.67 -7.32 49.81 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -81.47 -17.4 48.85 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.651 0.38 . . . . 0.0 111.353 -177.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 92.5 mmm -83.66 162.63 20.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.351 0.596 . . . . 0.0 111.487 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -167.74 168.76 12.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.612 1.565 . . . . 0.0 106.79 176.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -61.67 -34.25 75.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.379 0.536 . . . . 0.0 110.95 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -74.74 -29.51 61.19 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -74.23 -51.54 15.09 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 122.127 -0.358 . . . . 0.0 111.052 -175.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.7 p -72.6 -37.61 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -73.37 -32.06 64.29 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.13 -48.37 80.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 118.897 0.771 . . . . 0.0 111.403 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 31.0 t -56.69 -55.63 18.63 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 1.4 p90 -76.52 -5.8 49.11 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 29.0 t -77.4 -34.05 54.9 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.699 -0.626 . . . . 0.0 111.657 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . 0.478 ' C ' HD12 ' A' ' 402' ' ' LEU . 2.7 pp -62.66 -12.23 22.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 119.916 -0.714 . . . . 0.0 111.597 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.81 2.77 40.8 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 169.94 -144.38 8.48 Favored Glycine 0 CA--C 1.525 0.688 0 O-C-N 121.805 -0.559 . . . . 0.0 112.008 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -116.17 131.65 56.88 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.9 m -113.94 165.59 8.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -175.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -118.42 -65.95 1.12 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.563 0.345 . . . . 0.0 111.662 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . 0.458 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 36.2 mtmm -150.57 169.3 21.87 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.325 0.511 . . . . 0.0 111.914 -173.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.9 p -146.78 147.83 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 123.95 0.9 . . . . 0.0 109.264 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -154.63 140.74 18.44 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.582 0.353 . . . . 0.0 111.118 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.281 5.2 m-85 -94.44 156.52 16.44 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 117.052 2.242 . . . . 0.0 117.052 -178.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.4 mmt -93.75 125.17 38.22 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.008 0.523 . . . . 0.0 112.234 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.12 -14.32 59.2 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 124.311 1.044 . . . . 0.0 111.802 176.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 90.4 p -97.18 1.25 49.59 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.364 0.666 . . . . 0.0 112.483 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -131.44 152.81 81.15 Favored Pre-proline 0 CA--C 1.53 0.196 0 C-N-CA 123.165 0.586 . . . . 0.0 110.293 -175.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -71.07 -14.68 32.08 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.303 2.669 . . . . 0.0 111.737 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.21 90.81 0.08 OUTLIER Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.63 156.23 37.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.91 154.01 29.06 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.945 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.2 ptm -107.64 150.01 27.4 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 9.4 t -141.18 130.33 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -173.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -107.18 131.93 53.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 47.6 mtp -153.29 171.29 18.79 Favored 'General case' 0 C--O 1.231 0.092 0 C-N-CA 123.211 0.605 . . . . 0.0 109.377 -172.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.79 115.89 6.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 169.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -72.35 -33.44 67.27 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.78 -87.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -75.07 -25.56 58.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -175.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.35 -36.09 16.8 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.053 -174.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.57 -26.45 6.5 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.042 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -64.43 -53.4 49.01 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 117.981 0.355 . . . . 0.0 111.947 173.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -69.91 -29.18 66.29 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.01 80.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.599 0.636 . . . . 0.0 110.144 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.0 mt -78.6 -15.44 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.147 0.579 . . . . 0.0 110.73 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 45.3 m -91.37 -20.82 21.42 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.453 ' C ' HD22 ' A' ' 436' ' ' LEU . 97.1 m-70 -132.55 -24.35 2.01 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -169.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 435' ' ' HIS . 4.1 mm? -128.91 -12.14 4.75 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.731 1.605 . . . . 0.0 113.78 -172.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.606 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.79 101.07 2.51 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -168.468 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.56 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 17.3 m-80 78.85 21.82 0.69 Allowed 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 123.643 2.928 . . . . 0.0 113.639 -160.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -81.09 157.85 25.24 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.469 -0.769 . . . . 0.0 109.073 167.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -78.58 139.05 38.64 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.9 ttt -154.17 133.96 12.98 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . 0.404 ' CZ ' ' CD1' ' A' ' 558' ' ' PHE 0.356 53.5 m-85 56.69 22.6 6.98 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 -176.509 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.81 11.03 66.19 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.741 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -146.38 146.4 30.62 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 117.775 0.788 . . . . 0.0 111.002 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -77.61 149.95 34.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.996 0.518 . . . . 0.0 111.361 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.1 ptt? -131.48 83.67 2.12 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.494 0.717 . . . . 0.0 109.281 176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.56 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 28.9 t-20 -54.66 129.26 35.96 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.163 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.606 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.461 2.1 t -123.79 150.61 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 113.118 -3.433 . . . . 0.0 115.953 168.417 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 33.8 t -160.82 172.01 17.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.538 1.135 . . . . 0.0 108.211 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -73.23 147.19 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.6 t -86.78 155.68 20.22 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.226 0.61 . . . . 0.0 111.491 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -92.88 -7.53 45.96 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -77.58 145.7 71.91 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.049 0.94 . . . . 0.0 110.34 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.7 -33.87 2.11 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.019 2.48 . . . . 0.0 111.388 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.91 161.66 10.89 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.458 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 64.5 mt -83.61 129.03 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 mmm -91.93 122.41 65.29 Favored Pre-proline 0 N--CA 1.454 -0.257 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 174.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.81 144.02 47.35 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.665 2.243 . . . . 0.0 108.827 174.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 169.69 -134.56 3.22 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.582 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -72.55 160.9 31.52 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.371 0.669 . . . . 0.0 111.369 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.3 p -145.03 171.94 13.77 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.461 1.104 . . . . 0.0 109.546 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -133.65 -0.49 3.18 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.35 179.78 51.14 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 112.172 -0.371 . . . . 0.0 112.172 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 81.9 mt -143.37 154.19 43.48 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.864 0.866 . . . . 0.0 109.25 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -75.26 -4.08 36.97 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.447 0.299 . . . . 0.0 110.98 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -120.43 11.11 11.34 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.223 1.009 . . . . 0.0 113.698 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -163.74 -144.84 4.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.056 -1.218 . . . . 0.0 110.056 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 97.6 p -133.0 -24.52 1.89 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.269 0.534 . . . . 0.0 112.138 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.2 t -127.06 149.73 49.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.754 0.421 . . . . 0.0 110.286 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.2 p -91.7 9.89 30.57 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.28 0.632 . . . . 0.0 110.856 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -143.92 150.9 39.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -155.22 157.68 37.7 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.606 0.241 . . . . 0.0 110.363 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -133.31 133.69 42.88 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -176.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.64 1.43 9.46 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.7 p -72.86 -6.91 48.15 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.545 0.738 . . . . 0.0 111.314 -179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -113.95 16.79 18.23 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.885 0.874 . . . . 0.0 111.528 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -139.03 150.92 46.35 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.87 6.48 41.69 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.909 0.884 . . . . 0.0 112.185 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -63.5 -25.72 68.39 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -67.32 150.37 49.1 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -69.9 -33.78 72.65 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.337 -0.545 . . . . 0.0 112.071 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.418 56.6 m-85 -98.08 10.19 41.04 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 177.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.4 t -69.24 -21.66 63.91 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -171.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 1.1 p -133.3 150.86 76.4 Favored Pre-proline 0 CA--C 1.529 0.145 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -175.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.8 Cg_endo -70.53 -23.5 27.22 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.168 2.579 . . . . 0.0 112.0 -177.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -73.76 -24.11 59.82 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.452 0.569 . . . . 0.0 110.217 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -83.21 -52.72 6.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 174.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.25 -20.39 64.19 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.762 0.825 . . . . 0.0 112.622 -171.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.51 60.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 117.943 0.338 . . . . 0.0 111.634 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -124.03 6.65 8.59 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.61 155.44 15.52 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.492 0.587 . . . . 0.0 112.233 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -152.98 147.23 25.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.0 mm -136.61 151.45 28.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 C-N-CA 123.379 0.671 . . . . 0.0 109.734 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -155.99 158.02 37.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -61.84 154.94 64.92 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -62.39 144.06 94.44 Favored 'Trans proline' 0 N--CA 1.449 -1.096 0 C-N-CA 122.811 2.341 . . . . 0.0 109.909 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.9 t -153.45 -179.99 8.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -83.73 0.01 48.98 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.989 -0.444 . . . . 0.0 110.802 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.0 t -100.18 137.24 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.3 mt -125.59 159.81 31.19 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 109.134 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -128.81 147.03 50.76 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -133.52 159.89 39.07 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -150.62 163.57 38.19 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 56.93 43.49 24.63 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.154 -0.341 . . . . 0.0 111.537 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.52 150.8 39.44 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.13 153.46 32.71 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.448 2.765 . . . . 0.0 112.673 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 507' ' ' LEU . 3.7 mm? -68.55 -16.52 63.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.079 0.552 . . . . 0.0 111.581 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -122.95 24.07 9.11 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.514 0.726 . . . . 0.0 110.98 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.8 p -64.29 -13.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.665 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.76 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -165.836 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -25.55 -37.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -169.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.1 mt-10 -58.37 -48.69 79.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 117.244 -1.36 . . . . 0.0 114.22 171.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -86.21 -27.16 24.67 Favored 'General case' 0 C--N 1.352 0.68 0 CA-C-N 122.407 2.367 . . . . 0.0 106.747 -173.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -64.57 -39.81 94.41 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -71.97 -42.45 66.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.35 -26.85 56.15 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.042 -1.063 . . . . 0.0 111.155 -177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.9 mt -70.55 -39.61 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 CA-C-N 118.825 0.739 . . . . 0.0 110.456 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.04 -34.16 77.45 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.012 -0.43 . . . . 0.0 110.786 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -70.77 -27.19 63.74 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -80.53 -8.55 59.62 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.354 0.261 . . . . 0.0 111.618 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.4 mt -114.91 -2.88 12.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.738 0.415 . . . . 0.0 111.578 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.28 0.35 56.96 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 119.78 -0.455 . . . . 0.0 112.271 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.0 148.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 CA-C-N 117.778 0.789 . . . . 0.0 110.851 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -69.55 145.5 52.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 120.89 0.376 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 -71.26 150.68 94.4 Favored Pre-proline 0 N--CA 1.455 -0.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.412 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.2 158.73 56.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.841 3.028 . . . . 0.0 111.095 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -90.9 -23.13 20.59 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.6 m -154.13 152.16 30.1 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.979 0.511 . . . . 0.0 111.119 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.04 156.56 19.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.76 0.824 . . . . 0.0 112.993 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -153.67 143.25 21.73 Favored 'General case' 0 C--O 1.228 -0.046 0 C-N-CA 122.918 0.487 . . . . 0.0 109.824 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.29 149.33 25.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.498 0.719 . . . . 0.0 112.207 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -156.45 -171.52 3.73 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.3 t -140.68 -176.65 4.73 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.872 0.869 . . . . 0.0 109.948 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.8 74.44 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.847 0.737 . . . . 0.0 111.967 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -96.36 -17.03 20.94 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 117.429 0.614 . . . . 0.0 111.279 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 48.3 t -164.05 151.55 12.27 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.3 0.64 . . . . 0.0 110.082 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.06 -7.77 31.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.667 0.387 . . . . 0.0 110.546 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -86.68 -33.72 19.97 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.603 0.761 . . . . 0.0 112.465 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 96.4 p -162.89 173.37 13.79 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.076 0.465 . . . . 0.0 111.48 -169.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.4 t -88.31 166.69 14.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.485 0.714 . . . . 0.0 110.934 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.1 p -149.69 162.86 39.39 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.382 1.073 . . . . 0.0 108.427 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.44 -172.79 45.67 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.572 -177.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -113.3 159.45 19.36 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.595 0.758 . . . . 0.0 110.321 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 15.0 tp -145.64 152.19 39.25 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.963 0.905 . . . . 0.0 108.726 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -150.44 148.65 29.01 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-N 119.197 0.908 . . . . 0.0 112.921 -174.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -123.47 175.73 6.6 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 125.245 1.418 . . . . 0.0 112.802 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.61 -5.38 57.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 40.7 t -158.31 155.73 29.35 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.195 0.598 . . . . 0.0 110.61 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -72.67 -24.21 60.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.521 0.328 . . . . 0.0 111.12 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.8 p -79.16 -24.12 43.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.931 0.332 . . . . 0.0 110.442 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -76.99 -31.6 56.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.424 0.29 . . . . 0.0 111.385 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.77 -28.04 58.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.34 -39.78 62.59 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.162 -0.336 . . . . 0.0 111.073 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -70.15 -36.77 74.97 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.483 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.3 m -69.79 -27.8 65.2 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.87 -38.26 90.17 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.82 -38.32 94.25 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 442' ' ' PHE 0.298 8.0 m-85 -92.44 -3.0 55.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 119.214 3.042 . . . . 0.0 119.214 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 37.4 mt -133.92 -6.71 2.75 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -69.76 143.22 53.07 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 120.46 1.482 . . . . 0.0 108.991 176.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 60.49 18.94 8.72 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.119 0.968 . . . . 0.0 113.271 178.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 34.5 t80 -70.13 135.3 49.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.51 139.32 47.53 Favored 'General case' 0 C--O 1.23 0.069 0 O-C-N 122.001 -0.437 . . . . 0.0 112.168 -174.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.52 152.45 24.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.296 175.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 10.5 ptmm? . . . . . 0 CA--C 1.53 0.191 0 C-N-CA 123.839 0.856 . . . . 0.0 110.624 176.471 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.91 164.26 25.31 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 124.005 3.137 . . . . 0.0 111.792 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -129.88 142.33 50.68 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 102.006 -3.331 . . . . 0.0 102.006 171.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.274 0.6 OUTLIER -81.95 137.15 35.21 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -174.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -78.11 135.1 37.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.49 151.19 49.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.2 pp -151.38 166.48 30.91 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.489 0.662 . . . . 0.0 110.962 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 402' ' ' LEU . 45.2 t -159.81 163.0 34.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.781 0.832 . . . . 0.0 109.359 -174.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -57.52 124.74 20.04 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 172.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 34.0 t -75.1 149.03 39.22 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -170.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.271 0.6 OUTLIER -116.86 9.67 13.92 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 170.788 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.05 163.39 22.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.204 1.002 . . . . 0.0 111.816 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -92.5 -3.05 55.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.513 -178.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -155.14 174.61 14.96 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 123.572 0.749 . . . . 0.0 110.491 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.44 18.78 1.88 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.045 0.938 . . . . 0.0 109.855 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.221 -1.371 . . . . 0.0 110.918 -177.414 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.455 -0.752 0 N-CA-C 111.101 -0.384 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -156.66 159.69 38.65 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.746 0.418 . . . . 0.0 110.721 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.15 163.26 28.22 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.781 0.433 . . . . 0.0 111.209 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -71.53 -9.59 58.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.77 148.4 12.49 Favored Pre-proline 0 CA--C 1.53 0.21 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.162 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.13 -18.73 45.55 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.554 2.836 . . . . 0.0 112.085 172.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -87.6 153.32 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.5 tt -143.08 154.04 43.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.246 1.018 . . . . 0.0 108.907 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 77.3 mmm -132.01 141.73 49.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.62 0.368 . . . . 0.0 111.292 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.11 150.6 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -141.36 173.45 11.48 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 -175.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.56 8.59 80.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.849 -0.5 . . . . 0.0 111.849 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 29.06 0.19 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.696 0.798 . . . . 0.0 112.248 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.14 -37.3 86.98 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 388' ' ' GLN . 8.3 pm0 -67.35 149.61 50.08 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 33.8 t -70.45 -9.75 57.32 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.301 0.64 . . . . 0.0 112.582 -175.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -71.4 -21.21 62.03 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 121.897 -0.502 . . . . 0.0 111.621 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 55.1 mmm -82.29 145.93 29.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.078 -0.389 . . . . 0.0 110.696 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -160.27 156.07 25.82 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.256 1.022 . . . . 0.0 108.452 177.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.8 p -59.99 -29.23 68.32 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -70.97 -42.44 69.72 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.201 0.455 . . . . 0.0 111.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -75.98 -42.7 47.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -175.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.5 t -69.45 -42.24 80.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.409 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 2.3 t80 -76.9 -32.88 57.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -169.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . 0.418 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.5 p30 -74.17 -29.36 61.74 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 120.012 1.278 . . . . 0.0 109.897 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -59.67 -59.2 4.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.552 0.7 OUTLIER -76.65 -3.48 38.09 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 174.35 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 33.1 t -74.66 -37.77 62.63 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.873 -0.517 . . . . 0.0 111.323 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.37 -16.99 51.81 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -9.81 59.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 117.118 2.266 . . . . 0.0 117.118 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -174.03 -128.99 1.13 Allowed Glycine 0 CA--C 1.525 0.666 0 O-C-N 121.903 -0.498 . . . . 0.0 112.347 -175.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -138.08 127.0 23.98 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.563 0.745 . . . . 0.0 109.035 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.409 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.0 OUTLIER -114.07 165.57 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -175.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -122.35 -57.21 1.77 Allowed 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -154.52 162.55 41.09 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -142.8 152.54 17.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 124.474 1.11 . . . . 0.0 109.793 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -157.47 140.73 15.42 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -90.17 167.56 12.62 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 ptp -142.91 133.58 25.2 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 121.359 0.599 . . . . 0.0 111.7 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -5.66 54.62 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.648 1.179 . . . . 0.0 112.338 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 83.1 p -77.74 -1.23 30.24 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -140.24 156.37 69.98 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 124.452 1.101 . . . . 0.0 109.093 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -67.15 -12.57 36.49 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.181 2.587 . . . . 0.0 111.739 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.9 97.36 0.11 Allowed Glycine 0 C--N 1.337 0.621 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.33 159.82 37.88 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.963 0.505 . . . . 0.0 110.372 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -154.54 155.67 35.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.971 0.415 . . . . 0.0 111.048 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 43.7 ttm -108.98 148.76 30.24 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.479 1.112 . . . . 0.0 109.008 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.0 t -138.7 153.26 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 123.308 0.643 . . . . 0.0 111.431 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -140.8 132.52 27.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.332 0.515 . . . . 0.0 110.797 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 9.7 ptp -162.56 176.14 10.71 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.353 1.061 . . . . 0.0 110.535 -172.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.46 120.81 12.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 174.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -72.36 -33.47 67.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.42 -86.55 0.02 OUTLIER Glycine 0 CA--C 1.517 0.172 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.264 72.9 m-85 -74.78 -25.57 59.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -86.78 -37.19 18.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.905 -175.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.3 t -82.36 -32.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.339 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -69.22 -41.02 77.58 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -68.2 -38.61 82.15 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.52 0.6 . . . . 0.0 111.844 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -64.45 -35.29 80.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.277 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 51.5 mt -77.65 -15.89 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.184 0.594 . . . . 0.0 111.177 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 28.4 m -93.67 -19.47 21.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -133.67 -20.46 2.03 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 116.558 2.059 . . . . 0.0 116.558 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.36 -12.88 2.39 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 120.795 1.634 . . . . 0.0 114.648 -172.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.604 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.47 100.96 2.32 Favored 'General case' 0 C--O 1.201 -1.471 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -168.309 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.9 m-80 78.63 22.05 0.72 Allowed 'General case' 0 N--CA 1.484 1.256 0 O-C-N 117.614 -3.179 . . . . 0.0 114.051 -161.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -74.16 162.8 28.59 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.428 -0.795 . . . . 0.0 109.706 167.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -80.22 142.45 34.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 172.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.6 ttt -158.64 134.28 8.81 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.352 45.6 m-85 58.39 11.04 1.5 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 97.44 3.71 58.5 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -128.96 -165.01 1.45 Allowed 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.184 0.994 . . . . 0.0 108.933 176.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -126.1 149.88 48.6 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 122.683 0.393 . . . . 0.0 111.31 -177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.2 ptm -124.62 75.57 1.42 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.231 1.012 . . . . 0.0 109.637 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -51.98 127.06 20.2 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 115.618 -2.134 . . . . 0.0 112.821 -174.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.604 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.439 2.1 t -126.29 152.17 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 113.21 -3.396 . . . . 0.0 115.952 169.161 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.46 167.27 17.73 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.028 1.331 . . . . 0.0 109.069 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.94 147.48 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 40.4 t -87.49 159.78 18.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.901 0.481 . . . . 0.0 111.865 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -100.5 -8.04 23.55 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.377 0.271 . . . . 0.0 110.6 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -76.79 150.54 81.67 Favored Pre-proline 0 N--CA 1.455 -0.202 0 C-N-CA 123.477 0.711 . . . . 0.0 111.104 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.99 -36.11 1.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.558 2.839 . . . . 0.0 112.178 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.37 157.68 9.24 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.198 0.599 . . . . 0.0 110.726 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.02 142.96 13.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 78.7 mtp -115.27 126.78 27.43 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 122.072 0.149 . . . . 0.0 111.346 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.88 168.28 23.76 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.79 2.994 . . . . 0.0 109.875 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.47 -135.3 4.77 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -72.33 157.35 37.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.17 0.588 . . . . 0.0 109.663 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 470' ' ' SER . 96.6 p -148.79 177.88 9.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.593 0.357 . . . . 0.0 110.72 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -122.17 4.47 9.79 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 81.98 -177.54 53.8 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 54.8 mt -144.65 168.14 20.89 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 124.057 0.943 . . . . 0.0 109.911 -178.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.3 pm0 -66.16 -31.1 71.74 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.203 0.601 . . . . 0.0 110.447 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -120.51 12.11 11.5 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -155.95 172.11 33.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 112.044 -0.423 . . . . 0.0 112.044 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.9 m -100.42 -18.39 16.74 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 10.6 p -127.13 154.31 44.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.306 0.643 . . . . 0.0 111.457 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . 0.448 ' H ' ' HB2' ' A' ' 461' ' ' SER . 90.0 p -83.64 -3.55 57.83 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 122.777 0.431 . . . . 0.0 111.424 178.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.25 2.3 t80 -121.11 150.2 41.6 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -175.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -152.76 151.47 30.53 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.734 0.302 . . . . 0.0 111.131 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -119.36 138.04 53.33 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.07 5.01 4.14 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 115.969 1.841 . . . . 0.0 115.969 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 46.7 t -66.63 -28.48 68.51 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.746 0.418 . . . . 0.0 111.449 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -95.98 -6.66 38.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.892 0.477 . . . . 0.0 111.32 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.2 t -80.45 146.99 31.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.602 0.361 . . . . 0.0 111.201 -178.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -91.28 4.43 52.35 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.48 0.312 . . . . 0.0 111.106 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -63.93 -22.91 67.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.792 0.269 . . . . 0.0 111.017 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -60.81 134.16 56.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.501 0.72 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.7 tpt85 -80.96 -33.62 33.76 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -176.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.302 56.4 m-85 -97.99 11.95 35.84 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.685 2.476 . . . . 0.0 117.685 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 79.9 p -73.64 -10.35 59.61 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -172.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -136.47 147.81 61.42 Favored Pre-proline 0 N--CA 1.461 0.117 0 N-CA-C 115.405 1.631 . . . . 0.0 115.405 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.7 Cg_exo -64.77 -31.91 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.035 2.49 . . . . 0.0 112.392 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -79.15 -23.58 43.87 Favored 'General case' 0 CA--C 1.528 0.104 0 O-C-N 122.352 -0.218 . . . . 0.0 111.03 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -83.53 -41.34 18.06 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -61.33 -20.3 62.79 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.673 0.389 . . . . 0.0 111.874 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.75 -17.86 57.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -123.96 9.0 8.71 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -64.06 152.36 40.54 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.442 0.564 . . . . 0.0 111.998 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -143.85 125.97 15.49 Favored 'General case' 0 C--O 1.23 0.076 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.1 mm -143.38 -20.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.441 0.696 . . . . 0.0 110.838 -175.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 12.0 pm0 -65.4 160.67 21.44 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.513 0.725 . . . . 0.0 111.608 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 51.68 50.04 7.89 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 124.436 1.094 . . . . 0.0 113.893 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.67 146.6 84.54 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.634 2.223 . . . . 0.0 109.291 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 17.0 t -159.73 -157.91 0.61 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -175.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -83.74 0.6 46.52 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.319 0.648 . . . . 0.0 110.88 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 4.5 t -88.8 139.4 17.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 C-N-CA 123.337 0.655 . . . . 0.0 112.309 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.44 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 67.7 mt -122.19 156.63 33.31 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.458 0.703 . . . . 0.0 109.556 174.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -122.98 141.5 51.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -134.08 159.1 41.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.624 0.726 . . . . 0.0 110.706 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -151.51 163.37 39.16 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 103.093 -2.928 . . . . 0.0 103.093 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.48 57.33 4.42 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.551 0.341 . . . . 0.0 111.271 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -127.92 150.32 73.19 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.589 0.356 . . . . 0.0 111.1 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.37 153.36 34.66 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.7 2.933 . . . . 0.0 112.993 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 60.6 mt -68.54 -16.72 63.97 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.433 0.693 . . . . 0.0 112.506 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -122.81 23.84 9.28 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.838 0.855 . . . . 0.0 111.329 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.3 p -65.85 -12.01 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.709 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.35 -176.86 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -166.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.709 ' H ' HG22 ' A' ' 510' ' ' THR . 22.6 pt-20 -23.39 -41.49 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.0 -48.55 78.19 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 117.107 -1.425 . . . . 0.0 114.082 172.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -87.78 -27.59 22.22 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 122.481 2.4 . . . . 0.0 106.919 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -63.28 -37.74 88.43 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.308 -0.957 . . . . 0.0 113.521 175.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -73.47 -43.34 60.41 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.35 -21.17 56.47 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 119.99 -0.684 . . . . 0.0 111.823 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.7 mt -74.93 -37.6 41.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 174.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.5 m -66.22 -37.07 84.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.052 -0.405 . . . . 0.0 110.618 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -70.61 -26.86 63.69 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -74.98 -26.31 59.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.494 0.318 . . . . 0.0 110.831 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 82.2 mt -98.47 -5.26 32.72 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.05 0.54 . . . . 0.0 111.509 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.83 -1.37 54.25 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.406 0.527 . . . . 0.0 112.861 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.9 m -77.87 159.48 4.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 117.734 0.767 . . . . 0.0 112.527 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -69.38 146.14 52.34 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 123.014 0.526 . . . . 0.0 111.221 -178.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -74.73 154.43 87.25 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.727 0.811 . . . . 0.0 111.44 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.76 157.19 61.24 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.382 2.722 . . . . 0.0 110.33 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -90.16 -17.15 28.13 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.1 t -158.88 155.21 27.33 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.653 0.381 . . . . 0.0 110.624 177.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.7 m -142.84 153.83 17.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 C-N-CA 123.637 0.775 . . . . 0.0 113.039 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -150.19 142.29 24.03 Favored 'General case' 0 N--CA 1.458 -0.055 0 C-N-CA 123.479 0.712 . . . . 0.0 109.71 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.39 150.79 22.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -155.81 178.83 9.82 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 94.5 p -141.66 169.78 16.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.476 0.71 . . . . 0.0 110.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 116.91 -16.91 13.29 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 123.937 0.78 . . . . 0.0 111.959 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -84.71 -24.61 28.83 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 117.522 0.661 . . . . 0.0 112.285 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.6 t -163.13 155.41 18.29 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.937 0.495 . . . . 0.0 110.153 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.79 -7.64 33.18 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.598 0.359 . . . . 0.0 110.722 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.13 -31.67 44.21 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 95.8 p -165.47 170.44 14.43 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.051 0.453 . . . . 0.0 111.724 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 47.5 t -86.26 163.82 17.52 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.6 0.76 . . . . 0.0 110.16 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 68.4 m -141.99 161.38 38.12 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.978 0.911 . . . . 0.0 108.68 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.44 43.56 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 119.888 -1.149 . . . . 0.0 113.309 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -118.77 158.35 25.75 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.782 0.833 . . . . 0.0 110.229 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 84.3 mt -141.1 157.92 44.64 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 124.594 1.157 . . . . 0.0 108.645 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -147.62 150.27 34.1 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.359 0.527 . . . . 0.0 111.567 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . 0.44 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 15.7 m-90 -126.48 164.23 21.62 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.514 1.126 . . . . 0.0 112.202 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.01 -11.05 60.6 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.0 t -156.01 162.04 40.38 Favored 'General case' 0 C--N 1.339 0.138 0 O-C-N 121.536 -0.728 . . . . 0.0 111.57 -178.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -65.55 -31.82 73.07 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 122.887 0.475 . . . . 0.0 110.333 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 79.1 p -76.42 -28.46 56.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.215 0.206 . . . . 0.0 110.728 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -73.6 -34.44 65.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.62 -30.62 61.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 175.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 49.7 tp -74.92 -38.82 61.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 122.331 0.252 . . . . 0.0 111.334 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -74.1 -40.08 62.95 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.844 -0.535 . . . . 0.0 110.044 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.8 -24.67 62.61 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -68.23 -34.87 77.03 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 171.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -68.97 -32.43 73.34 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.491 -0.616 . . . . 0.0 112.302 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.287 8.2 m-85 -95.59 -9.7 31.53 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.92 -11.19 11.54 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-N 119.082 0.856 . . . . 0.0 113.254 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -74.38 138.68 43.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 119.153 0.888 . . . . 0.0 109.331 178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 60.36 22.51 12.03 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.581 0.752 . . . . 0.0 112.484 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 29.1 t80 -81.54 145.77 30.5 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -73.8 144.58 45.51 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.78 -0.575 . . . . 0.0 111.869 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 65.5 mtm -83.54 152.54 24.84 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 172.04 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.1 p90 . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.87 162.08 43.02 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.466 2.777 . . . . 0.0 111.031 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.93 142.34 50.66 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.47 131.18 44.34 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -174.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.75 147.99 24.94 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.277 1.031 . . . . 0.0 109.347 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -140.8 154.11 46.1 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.793 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -158.59 161.37 37.24 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 27.0 p -158.36 174.82 14.55 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.495 0.718 . . . . 0.0 110.254 -176.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -59.73 124.26 19.56 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 30.2 t -85.67 150.35 24.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -110.38 9.25 23.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.66 163.37 16.51 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.609 0.764 . . . . 0.0 111.827 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 -89.58 -3.08 58.46 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.98 178.02 4.11 Favored 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 123.415 0.686 . . . . 0.0 110.142 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -136.72 18.83 3.06 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.74 0.416 . . . . 0.0 111.568 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.501 -1.238 . . . . 0.0 110.526 179.946 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 N--CA 1.454 -0.809 0 CA-C-O 120.831 0.263 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -155.38 160.33 40.61 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 110.893 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.98 161.41 31.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.828 0.451 . . . . 0.0 111.134 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -70.6 -5.08 26.61 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.55 145.68 10.97 Favored Pre-proline 0 N--CA 1.456 -0.127 0 O-C-N 122.183 -0.323 . . . . 0.0 111.446 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.78 -18.69 62.03 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.672 2.915 . . . . 0.0 111.626 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 5.3 t -94.57 153.68 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 C-N-CA 123.607 0.763 . . . . 0.0 112.194 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -141.09 153.52 45.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.271 1.028 . . . . 0.0 108.789 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 74.1 mmm -130.39 133.73 46.6 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 122.91 0.484 . . . . 0.0 111.695 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.75 151.78 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.22 177.99 8.22 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 105.38 -2.082 . . . . 0.0 105.38 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 82.3 12.04 81.25 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 112.034 -0.427 . . . . 0.0 112.034 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 48.8 mt -78.24 26.26 0.21 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.514 0.657 . . . . 0.0 112.203 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -64.37 -37.89 89.1 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -176.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.451 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.6 pm0 -67.07 150.42 49.22 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.182 0.515 . . . . 0.0 111.055 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -70.04 -8.71 51.52 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.666 0.786 . . . . 0.0 112.974 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -76.85 -13.88 59.95 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.73 0.412 . . . . 0.0 111.676 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 56.4 mmm -85.07 152.15 23.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.963 0.411 . . . . 0.0 111.099 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.73 155.37 23.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 175.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 411' ' ' PHE . 24.2 p -57.42 -32.0 66.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -175.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.06 -47.97 63.96 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 175.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.9 mtt85 -70.55 -39.11 74.17 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 116.821 -0.172 . . . . 0.0 110.972 -171.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.74 -46.35 74.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -77.68 -28.65 51.17 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.712 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -77.31 -29.11 53.51 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.392 0.997 . . . . 0.0 110.097 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . 0.576 HG22 HD12 ' A' ' 556' ' ' LEU . 2.7 t -59.93 -56.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.555 2.3 p90 -76.66 -3.21 36.65 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 173.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.503 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.4 t -73.01 -36.87 67.08 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.866 -0.521 . . . . 0.0 110.559 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.15 -11.67 22.11 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.779 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -89.22 -3.79 58.44 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.95 -169.82 41.05 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 118.795 0.725 . . . . 0.0 112.91 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -78.46 114.28 17.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 401' ' ' CYS . 2.5 m -114.09 165.49 9.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -127.87 -59.49 1.19 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -154.42 167.81 28.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -172.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.1 150.42 15.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 124.827 1.251 . . . . 0.0 109.84 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -151.54 128.78 11.21 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 123.353 0.661 . . . . 0.0 110.805 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 393' ' ' CYS . 3.3 m-85 -82.84 156.95 23.35 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 117.396 2.369 . . . . 0.0 117.396 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.17 127.77 37.77 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.712 0.405 . . . . 0.0 110.846 175.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . 0.578 ' H ' ' CD ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.21 -29.14 42.66 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.849 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 52.2 p -102.02 -19.51 15.17 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -80.5 154.27 73.9 Favored Pre-proline 0 CA--C 1.528 0.129 0 CA-C-N 118.456 0.571 . . . . 0.0 110.047 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.84 -15.87 48.39 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.085 2.523 . . . . 0.0 111.136 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 166.66 98.19 0.12 Allowed Glycine 0 C--N 1.336 0.538 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 176.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.17 37.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.334 0.654 . . . . 0.0 110.209 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.75 148.85 19.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 62.8 mtp -85.03 150.77 24.64 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.348 1.059 . . . . 0.0 109.037 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.89 146.39 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 C-N-CA 123.48 0.712 . . . . 0.0 110.414 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.44 ' C ' ' HG3' ' A' ' 423' ' ' MET . 71.4 tt0 -129.42 129.81 45.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.374 0.534 . . . . 0.0 109.888 176.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . 0.546 ' HE2' ' HB1' ' A' ' 428' ' ' ALA . 49.9 mtp -150.77 167.68 26.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.335 1.054 . . . . 0.0 109.389 -169.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.76 122.38 17.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 170.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -72.34 -33.21 67.12 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -167.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.45 -89.57 0.01 OUTLIER Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.56 -25.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.546 ' HB1' ' HE2' ' A' ' 423' ' ' MET . . . -89.52 -35.15 16.1 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.99 -174.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 81.6 t -85.94 -26.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.345 0.401 0 C-N-CA 118.217 -1.393 . . . . 0.0 109.025 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -68.42 -50.06 55.51 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -66.91 -33.18 75.02 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 120.266 -0.574 . . . . 0.0 112.262 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.23 -36.72 82.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.841 0.746 . . . . 0.0 110.2 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.1 mt -79.21 -8.1 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.55 0.74 . . . . 0.0 111.184 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.7 m -100.08 -21.26 15.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -124.53 -27.77 3.68 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 -169.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.7 mt -134.52 -10.63 2.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.483 1.492 . . . . 0.0 114.711 -173.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.647 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -71.86 100.77 2.48 Favored 'General case' 0 C--O 1.204 -1.335 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -169.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.4 m-80 76.73 22.16 1.17 Allowed 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 123.381 2.81 . . . . 0.0 112.811 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.52 161.3 18.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 168.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.271 37.6 m-85 -74.47 138.4 43.2 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.0 ttt -157.11 142.53 17.37 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.386 0.674 . . . . 0.0 109.603 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 59.34 17.55 5.95 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.42 85.31 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -173.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -133.32 -159.35 0.96 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.773 1.629 . . . . 0.0 108.598 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -128.62 151.02 49.96 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.551 0.341 . . . . 0.0 110.779 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -129.25 82.58 2.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -58.69 127.4 31.99 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 115.98 -1.962 . . . . 0.0 113.343 -172.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.647 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.409 2.1 t -129.94 150.93 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 113.593 -3.243 . . . . 0.0 115.953 168.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.3 t -161.49 167.7 25.02 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.585 1.154 . . . . 0.0 109.27 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -72.31 150.86 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 41.6 t -90.71 166.56 13.07 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.334 0.653 . . . . 0.0 111.492 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -106.13 -6.42 18.61 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.621 0.368 . . . . 0.0 110.455 175.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -77.74 152.03 80.13 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 123.98 0.912 . . . . 0.0 111.613 -178.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.52 -38.89 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 123.14 2.56 . . . . 0.0 112.045 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.55 159.38 10.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.608 0.763 . . . . 0.0 110.479 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 64.9 mt -80.51 128.87 38.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 24.8 mmm -94.78 140.61 22.62 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.361 0.265 . . . . 0.0 111.292 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -73.38 158.18 48.59 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 123.318 2.679 . . . . 0.0 109.065 172.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 160.33 -133.95 3.45 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.694 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -72.31 167.8 19.69 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.441 0.696 . . . . 0.0 111.419 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.7 p -154.83 167.78 29.09 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.738 0.815 . . . . 0.0 109.785 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.78 -1.61 0.98 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.62 -171.14 54.41 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.5 mt -142.26 159.96 41.19 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.138 0.975 . . . . 0.0 109.229 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.55 -19.34 62.9 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -120.44 25.5 9.76 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -160.66 -159.15 9.71 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.7 t -133.0 -15.95 2.56 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 80.1 m -127.04 143.69 51.22 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.595 0.358 . . . . 0.0 111.441 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 71.9 p -93.84 3.47 55.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.348 0.659 . . . . 0.0 110.894 175.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -142.74 149.57 38.92 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.115 1.366 . . . . 0.0 114.254 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -154.61 152.88 30.53 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 117.994 0.361 . . . . 0.0 111.454 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -124.24 128.88 49.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.203 1.401 . . . . 0.0 112.45 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.282 3.3 m-85 -91.22 -6.64 53.07 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -177.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.7 t -75.09 -33.52 61.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -81.22 -17.07 50.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.575 0.35 . . . . 0.0 110.468 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 54.7 m -91.31 -3.81 56.47 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 60.91 -1.93 0.22 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.755 1.222 . . . . 0.0 113.204 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -64.73 -22.36 66.96 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.097 0.559 . . . . 0.0 112.064 -176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -59.42 115.6 3.38 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -81.02 -24.14 38.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.331 -0.395 . . . . 0.0 112.015 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.301 62.5 m-85 -97.94 17.44 18.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -64.1 -20.05 65.69 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.04 154.1 70.03 Favored Pre-proline 0 C--O 1.232 0.156 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 177.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -64.1 -23.49 67.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.087 2.525 . . . . 0.0 111.679 177.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -75.76 -29.46 58.82 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.331 -0.231 . . . . 0.0 110.675 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -82.0 -38.95 24.3 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.56 -19.67 65.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.667 0.387 . . . . 0.0 111.81 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.82 -16.73 54.91 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.0 0.37 8.52 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -65.33 157.25 29.66 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.289 178.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.71 118.28 10.96 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.93 41.85 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.437 0.695 . . . . 0.0 111.042 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -64.68 167.92 6.73 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.904 -0.498 . . . . 0.0 110.092 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -57.6 151.12 42.23 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 122.693 0.397 . . . . 0.0 110.777 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.12 162.27 36.42 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 123.479 2.786 . . . . 0.0 110.838 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 33.2 t -158.05 -176.86 6.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -83.68 -3.72 57.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -88.13 146.42 6.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 123.621 0.768 . . . . 0.0 112.572 175.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 8.8 tp -137.38 152.23 49.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.027 0.531 . . . . 0.0 109.833 -178.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -123.9 147.75 47.41 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.838 0.855 . . . . 0.0 109.131 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -142.29 161.53 37.79 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.689 0.757 . . . . 0.0 109.983 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -153.7 166.12 33.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 58.25 57.44 3.95 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.646 0.378 . . . . 0.0 111.434 -174.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -124.86 154.9 70.86 Favored Pre-proline 0 CA--C 1.533 0.299 0 C-N-CA 123.629 0.772 . . . . 0.0 109.935 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.41 156.74 64.91 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.202 1.935 . . . . 0.0 110.305 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.42 -16.53 63.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -173.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -115.36 25.14 11.06 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.5 0.72 . . . . 0.0 111.385 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.85 -14.24 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.96 -177.25 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -164.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.699 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.53 -39.4 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.1 mt-10 -59.27 -45.88 90.03 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 116.956 -1.497 . . . . 0.0 114.77 172.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -88.22 -27.18 21.95 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 122.852 2.569 . . . . 0.0 106.865 -174.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -65.77 -36.08 82.52 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.426 -0.909 . . . . 0.0 113.308 175.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -74.08 -44.26 54.68 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -76.59 -25.0 53.47 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.755 -0.778 . . . . 0.0 111.739 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.2 mt -72.22 -40.56 65.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 O-C-N 121.75 -0.594 . . . . 0.0 110.027 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 74.3 m -65.31 -30.24 71.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.23 0.468 . . . . 0.0 111.294 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -66.91 -39.44 87.4 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.915 0.388 . . . . 0.0 112.026 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -73.42 -6.75 48.29 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.04 -3.73 12.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.865 0.466 . . . . 0.0 111.778 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.88 -16.71 3.15 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.995 0.807 . . . . 0.0 113.931 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.5 m -77.39 156.8 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 118.461 1.13 . . . . 0.0 108.771 177.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -70.83 150.33 45.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.087 0.47 . . . . 0.0 111.496 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -76.19 157.41 83.1 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.311 0.644 . . . . 0.0 110.065 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.41 151.09 83.93 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 122.959 2.44 . . . . 0.0 110.549 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.0 t -83.53 -22.98 32.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -148.67 150.61 33.51 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.282 0.633 . . . . 0.0 110.665 178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.8 m -144.52 156.1 14.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 C-N-CA 123.655 0.782 . . . . 0.0 112.676 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -154.71 144.67 21.74 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.529 0.732 . . . . 0.0 109.505 175.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.96 152.48 28.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -155.51 -177.75 6.78 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.994 1.849 . . . . 0.0 115.994 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.1 p -143.49 -170.34 3.27 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.211 1.004 . . . . 0.0 109.846 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.56 -9.22 62.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.758 0.694 . . . . 0.0 112.254 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -94.43 -26.91 16.3 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 117.54 0.67 . . . . 0.0 111.648 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.4 t -164.59 156.94 16.44 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.235 0.614 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.99 -8.03 31.54 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.842 0.457 . . . . 0.0 110.787 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.26 -33.64 37.7 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 28.0 t -164.94 157.43 16.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.63 0.252 . . . . 0.0 111.651 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 95.3 p -82.9 176.24 9.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.454 0.702 . . . . 0.0 111.051 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.0 t -149.05 162.71 39.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.095 0.958 . . . . 0.0 108.445 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.31 -174.45 47.0 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.124 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.52 160.18 23.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.598 0.759 . . . . 0.0 110.394 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.5 mt -139.77 161.33 37.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.113 1.365 . . . . 0.0 108.347 178.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -151.38 148.39 28.07 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.248 -0.282 . . . . 0.0 111.573 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 22.2 m-90 -129.07 173.67 10.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.877 1.271 . . . . 0.0 111.915 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -7.99 54.74 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 46.8 t -162.03 165.06 27.83 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.193 -0.317 . . . . 0.0 111.295 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.92 -37.62 86.54 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 122.968 0.507 . . . . 0.0 110.269 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.2 p -72.26 -27.26 62.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -71.8 -39.75 69.67 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 175.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.6 -27.14 60.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 62.4 tp -77.89 -40.35 40.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -178.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -70.96 -36.76 72.69 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.65 -23.78 59.91 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . 0.576 HD12 HG22 ' A' ' 399' ' ' VAL . 0.9 OUTLIER -67.85 -44.57 76.83 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -61.55 -37.16 93.72 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-O 119.668 -0.518 . . . . 0.0 112.113 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.292 25.2 m-85 -84.95 -13.33 51.05 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.9 mt -110.81 -10.15 14.45 Favored 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -72.62 144.19 47.91 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.274 0.943 . . . . 0.0 108.829 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 58.77 18.96 6.44 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.952 0.901 . . . . 0.0 112.852 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.45 131.78 51.29 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -77.38 124.83 28.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 121.866 -0.522 . . . . 0.0 110.747 -177.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.0 mtm -83.54 152.57 24.82 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.287 0.235 . . . . 0.0 111.406 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.483 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.6 p90 . . . . . 0 C--O 1.231 0.124 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.99 167.41 27.12 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.889 3.059 . . . . 0.0 111.266 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -129.87 142.44 50.67 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 103.177 -2.897 . . . . 0.0 103.177 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.271 0.7 OUTLIER -81.63 141.14 33.95 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -178.018 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.8 tt -86.46 152.52 22.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.954 1.302 . . . . 0.0 109.455 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.0 pttp -140.44 153.53 46.32 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.159 0.436 . . . . 0.0 110.697 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.46 161.71 38.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.191 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.5 p -161.6 171.52 17.89 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.971 0.909 . . . . 0.0 110.908 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -55.67 125.33 20.67 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 31.2 t -81.65 150.16 28.19 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -171.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -113.72 9.3 17.71 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.91 163.15 20.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.831 0.852 . . . . 0.0 111.542 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -89.41 -7.27 55.51 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.347 0.659 . . . . 0.0 111.776 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -172.49 172.21 4.41 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.668 0.787 . . . . 0.0 110.273 176.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -140.92 20.31 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.243 0.617 . . . . 0.0 111.793 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.2 t . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.691 -1.147 . . . . 0.0 110.499 179.878 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo . . . . . 0 N--CA 1.454 -0.849 0 CA-C-O 120.6 0.167 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -157.72 153.52 26.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.801 0.44 . . . . 0.0 110.701 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -77.8 157.78 29.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.468 0.307 . . . . 0.0 110.3 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 8.6 p30 -84.02 6.57 21.56 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 115.886 1.809 . . . . 0.0 115.886 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 29.8 t -153.72 143.98 15.62 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 119.387 -0.339 . . . . 0.0 111.105 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.5 Cg_exo -62.22 -3.03 3.56 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.387 3.391 . . . . 0.0 113.455 176.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.06 151.01 28.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -122.37 153.54 38.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.526 1.531 . . . . 0.0 108.291 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.7 tpt -135.13 128.41 32.08 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 117.773 0.26 . . . . 0.0 110.64 -176.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -122.4 153.23 26.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -175.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -142.98 175.91 9.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.365 -2.458 . . . . 0.0 104.365 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.64 15.91 67.17 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 37.7 mt -86.46 19.6 2.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.389 0.675 . . . . 0.0 111.557 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.321 8.4 p30 -73.48 32.29 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 117.285 2.328 . . . . 0.0 117.285 -173.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -140.55 154.54 46.57 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 110.29 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 86.8 p -66.05 -11.45 48.44 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -78.63 -9.49 59.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.203 0.456 . . . . 0.0 111.635 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 60.1 mmm -97.32 149.75 21.74 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 117.936 0.334 . . . . 0.0 110.224 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -161.55 154.86 21.2 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 22.3 p -59.18 -35.8 74.19 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.16 -38.71 78.89 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -74.4 -51.33 15.3 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.98 -33.9 63.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.211 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.427 ' HA ' ' CE1' ' A' ' 400' ' ' PHE . 5.5 t80 -75.66 -30.64 59.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.584 -174.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -74.83 -32.46 61.95 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.443 1.019 . . . . 0.0 110.068 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . 0.431 HG22 ' CD2' ' A' ' 556' ' ' LEU . 30.0 t -57.52 -57.7 9.13 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 397' ' ' PHE 0.49 2.6 p90 -76.54 -5.08 46.08 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 117.646 2.462 . . . . 0.0 117.646 174.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.456 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.5 t -74.32 -34.54 63.48 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 118.198 0.453 . . . . 0.0 111.133 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' A' ' 403' ' ' TYR . 3.0 pp -61.41 -16.46 46.9 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.959 177.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 402' ' ' LEU 0.252 55.2 m-85 -85.08 -5.28 59.35 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 118.298 2.703 . . . . 0.0 118.298 -179.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.91 -167.07 39.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.475 -0.869 . . . . 0.0 113.303 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -84.95 120.06 26.07 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.683 0.793 . . . . 0.0 109.361 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.456 HG11 ' HA ' ' A' ' 401' ' ' CYS . 1.4 m -113.94 165.49 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.053 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -174.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -133.36 -57.36 0.9 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -149.79 164.28 35.72 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.44 147.01 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 124.625 1.17 . . . . 0.0 109.073 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.4 130.36 11.0 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.335 0.254 . . . . 0.0 111.64 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.3 m-85 -85.0 156.08 21.29 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.9 mmt -95.75 118.02 31.63 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.534 0.733 . . . . 0.0 112.244 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -79.11 -14.35 59.18 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.914 0.485 . . . . 0.0 111.124 172.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.7 p -90.26 1.47 56.47 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.625 0.77 . . . . 0.0 111.875 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -136.06 155.21 77.76 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 123.664 0.786 . . . . 0.0 110.46 -176.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.76 -15.67 33.37 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.249 2.633 . . . . 0.0 111.624 178.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.78 95.21 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.14 159.42 36.16 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.879 0.872 . . . . 0.0 109.281 177.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.56 156.64 21.1 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 71.8 mtm -102.58 154.73 18.84 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.427 0.691 . . . . 0.0 109.997 172.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.05 124.93 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 123.314 0.646 . . . . 0.0 110.893 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -103.62 127.84 51.0 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtm -154.63 172.4 17.92 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.796 0.838 . . . . 0.0 109.85 -174.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.79 122.07 16.04 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -72.35 -33.47 67.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.79 -87.97 0.01 OUTLIER Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -73.01 -26.81 61.46 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 117.185 2.291 . . . . 0.0 117.185 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.8 -37.19 19.52 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.052 -1.059 . . . . 0.0 111.798 -174.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.0 t -85.87 -26.22 6.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.622 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -66.42 -51.91 52.0 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.164 -0.335 . . . . 0.0 111.391 175.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -69.93 -31.15 68.77 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.38 72.66 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.915 0.78 . . . . 0.0 110.089 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -78.11 -15.48 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 123.222 0.609 . . . . 0.0 110.752 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.4 m -93.01 -18.88 22.15 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.458 ' C ' HD22 ' A' ' 436' ' ' LEU . 95.7 m-70 -129.77 -21.37 3.08 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -170.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.5 mm? -134.71 -12.34 2.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.956 1.707 . . . . 0.0 114.311 -174.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.73 100.92 2.45 Favored 'General case' 0 C--O 1.205 -1.237 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -168.172 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.58 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 15.0 m-80 77.04 21.51 1.11 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 123.159 2.709 . . . . 0.0 113.771 -161.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -78.84 161.32 26.85 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.94 -1.1 . . . . 0.0 111.155 168.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . 0.418 ' CZ ' ' HE3' ' A' ' 445' ' ' LYS . 55.7 m-85 -71.3 142.42 50.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.2 ttt -162.5 134.52 5.42 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.392 50.8 m-85 55.98 27.32 11.06 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 83.72 8.78 84.02 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -132.5 178.33 6.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.315 1.046 . . . . 0.0 109.266 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . 0.418 ' HE3' ' CZ ' ' A' ' 440' ' ' PHE . 40.1 ttmt -125.19 133.75 52.64 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 111.033 178.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 63.0 mtm -80.63 -158.18 0.18 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.404 1.082 . . . . 0.0 109.046 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.58 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 37.1 t-20 -162.59 123.26 2.46 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 115.631 -2.128 . . . . 0.0 108.599 168.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.45 2.2 t -125.86 151.42 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 112.337 -3.745 . . . . 0.0 116.556 170.371 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 26.1 t -161.38 174.94 12.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.714 1.606 . . . . 0.0 107.938 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.2 p -73.95 149.36 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.3 t -84.21 158.45 21.29 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.882 0.473 . . . . 0.0 110.973 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -104.45 -1.81 26.21 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.459 -0.151 . . . . 0.0 110.692 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -86.79 146.47 41.18 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 123.176 0.59 . . . . 0.0 110.066 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.57 -31.14 4.49 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.319 2.68 . . . . 0.0 112.493 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.47 161.28 13.81 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.022 0.529 . . . . 0.0 110.382 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 79.0 mt -87.76 136.54 22.9 Favored 'Isoleucine or valine' 0 C--O 1.23 0.062 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 59.8 mmm -101.39 130.16 25.38 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.458 0.303 . . . . 0.0 110.913 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.54 171.42 18.07 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.608 2.872 . . . . 0.0 110.402 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 131.41 -125.41 4.4 Favored Glycine 0 C--N 1.336 0.551 0 N-CA-C 111.424 -0.67 . . . . 0.0 111.424 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -72.47 164.91 25.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.361 0.6 . . . . 0.0 112.21 -176.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 97.0 p -158.4 -179.16 7.84 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.154 0.981 . . . . 0.0 109.529 -177.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -140.88 161.96 36.58 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -80.65 131.69 10.67 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.4 mt -80.0 166.81 21.2 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.07 -22.57 64.0 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.248 -0.282 . . . . 0.0 111.178 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -120.52 25.83 9.54 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.154 0.582 . . . . 0.0 110.242 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.36 -163.07 14.33 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 121.859 -0.526 . . . . 0.0 112.419 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 48.4 t -133.09 -16.69 2.46 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.061 0.544 . . . . 0.0 111.551 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.5 t -127.09 145.98 50.54 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.957 0.503 . . . . 0.0 110.059 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 89.8 p -97.47 9.51 42.19 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.403 0.681 . . . . 0.0 111.628 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -136.15 147.24 47.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -157.84 154.15 27.55 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.606 0.362 . . . . 0.0 110.188 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 2.4 t0 -131.85 130.3 41.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -93.63 -8.89 39.8 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 117.252 2.315 . . . . 0.0 117.252 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 48.3 t -87.19 -32.27 19.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -79.25 3.8 16.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.568 0.747 . . . . 0.0 111.711 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 77.4 p -134.21 9.01 3.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.292 0.637 . . . . 0.0 111.767 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 62.77 -0.86 0.52 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.845 1.258 . . . . 0.0 113.986 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -59.21 -26.6 64.98 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.698 -0.626 . . . . 0.0 111.864 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -56.32 124.21 17.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.167 0.987 . . . . 0.0 109.994 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -81.02 -32.14 34.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -172.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.306 63.2 m-85 -97.92 17.1 18.99 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -69.12 -14.31 62.92 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -173.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.58 151.75 71.53 Favored Pre-proline 0 C--O 1.232 0.139 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 33.5 Cg_exo -65.0 -23.83 60.88 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 123.02 2.48 . . . . 0.0 111.426 176.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -75.71 -29.7 59.05 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.359 0.263 . . . . 0.0 110.452 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -82.4 -41.98 19.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 174.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.83 64.81 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -80.79 -19.04 45.66 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -4.5 7.96 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -63.67 157.14 24.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.276 0.489 . . . . 0.0 110.414 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -150.44 144.83 25.66 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.4 mm -137.65 148.05 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 123.331 0.652 . . . . 0.0 110.225 -171.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -150.51 169.04 22.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.108 0.963 . . . . 0.0 110.186 178.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -62.88 155.92 69.02 Favored Pre-proline 0 N--CA 1.455 -0.213 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -62.21 145.49 96.19 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 122.521 2.147 . . . . 0.0 109.561 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.2 t -153.98 173.99 15.25 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.978 0.511 . . . . 0.0 109.653 -174.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.71 -3.06 57.47 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.268 -0.27 . . . . 0.0 110.935 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -98.38 135.86 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.437 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 64.8 mt -125.41 152.14 45.25 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.372 0.669 . . . . 0.0 109.717 174.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -110.51 143.59 40.64 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 173.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -131.28 157.77 42.42 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.224 0.535 . . . . 0.0 111.647 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -152.19 167.68 27.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 103.847 -2.649 . . . . 0.0 103.847 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 54.39 31.87 15.39 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -93.57 156.21 39.93 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 117.685 0.22 . . . . 0.0 110.864 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.73 151.14 57.65 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 123.326 2.684 . . . . 0.0 111.754 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.46 -16.58 63.95 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.315 0.646 . . . . 0.0 112.412 -177.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -122.67 26.42 8.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.579 0.752 . . . . 0.0 111.005 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.57 -14.22 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.3 OUTLIER -54.74 -177.39 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -165.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.705 ' H ' HG22 ' A' ' 510' ' ' THR . 84.6 tt0 -10.33 -53.74 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.176 1.79 . . . . 0.0 114.919 -174.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.5 mt-10 -61.4 -41.18 96.72 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -89.35 -27.33 20.56 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 123.262 2.755 . . . . 0.0 106.398 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -61.71 -39.96 93.37 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.875 -1.13 . . . . 0.0 113.09 174.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -70.47 -45.95 64.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -77.88 -24.95 48.33 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 119.918 -0.713 . . . . 0.0 111.468 -177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 53.2 mt -70.53 -39.14 75.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 118.867 0.758 . . . . 0.0 109.417 176.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 85.6 m -65.66 -32.8 74.56 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.98 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -70.16 -27.18 64.33 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -80.02 -9.19 59.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.273 0.229 . . . . 0.0 111.577 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.26 -5.95 14.61 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.096 0.558 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.55 -10.06 13.48 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 123.715 0.674 . . . . 0.0 113.025 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.9 m -79.82 159.03 4.46 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.102 0 CA-C-N 118.131 0.966 . . . . 0.0 112.45 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -67.59 148.44 51.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 121.179 0.514 . . . . 0.0 111.376 -176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -81.6 158.07 68.97 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.602 0.761 . . . . 0.0 110.884 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.24 170.88 12.41 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 123.864 3.043 . . . . 0.0 110.43 172.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -119.21 -17.97 8.77 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 64.5 m -147.49 146.84 29.65 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 123.187 0.595 . . . . 0.0 109.884 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.24 156.94 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -175.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -150.34 141.05 22.66 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -138.53 142.17 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -154.06 -172.79 4.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 22.8 t -136.84 -174.29 3.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.625 0.77 . . . . 0.0 110.11 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.88 -15.53 62.53 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.04 0.828 . . . . 0.0 111.758 -178.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 50.4 mmtm -88.46 -28.32 20.93 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.453 0.627 . . . . 0.0 110.742 175.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.9 t -166.31 158.93 14.4 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.76 . . . . 0.0 109.963 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -117.05 -4.19 11.5 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.441 0.696 . . . . 0.0 109.855 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -24.26 21.55 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.654 0.782 . . . . 0.0 110.637 -179.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 13.0 m -158.71 167.17 30.22 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.763 0.825 . . . . 0.0 111.073 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 46.9 t -79.61 164.13 24.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.64 0.776 . . . . 0.0 111.569 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 39.6 t -151.95 150.42 30.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.479 1.111 . . . . 0.0 109.376 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 170.56 -173.6 44.43 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.815 -178.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -112.05 157.66 20.5 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 123.318 0.647 . . . . 0.0 110.17 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 28.2 tp -146.32 151.74 38.01 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -147.04 149.25 32.73 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . 0.437 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 17.7 m-90 -121.38 172.0 8.36 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.491 1.516 . . . . 0.0 112.536 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -74.99 -11.07 60.03 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.612 0.365 . . . . 0.0 111.137 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -156.72 158.96 37.86 Favored 'General case' 0 C--O 1.232 0.135 0 O-C-N 121.629 -0.669 . . . . 0.0 111.375 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.5 -26.25 62.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.537 0.335 . . . . 0.0 110.851 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.1 p -78.64 -25.53 45.01 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.75 -35.36 70.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 175.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.4 -28.55 59.48 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.755 -0.202 . . . . 0.0 110.665 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 39.6 tp -72.79 -44.02 62.06 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 117.875 0.307 . . . . 0.0 111.131 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -72.72 -39.48 66.89 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.904 -0.498 . . . . 0.0 109.947 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.47 -26.92 65.73 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . 0.431 ' CD2' HG22 ' A' ' 399' ' ' VAL . 5.7 tt -68.23 -32.39 72.56 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 172.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.39 -41.48 99.76 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.265 10.5 m-85 -89.05 -18.79 26.59 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.743 2.868 . . . . 0.0 118.743 178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.81 -16.68 15.33 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.754 0.706 . . . . 0.0 112.323 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -73.82 143.81 45.78 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 119.317 0.962 . . . . 0.0 108.846 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.85 18.45 2.99 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.516 1.126 . . . . 0.0 112.966 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.264 43.8 t80 -72.88 138.55 46.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -73.86 134.03 43.24 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.131 -0.356 . . . . 0.0 111.813 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.6 mtm -84.58 152.6 23.75 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 122.679 0.392 . . . . 0.0 111.663 176.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.168 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 170.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.7 p90 . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -74.59 163.51 35.79 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.663 2.909 . . . . 0.0 111.238 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -129.91 142.33 50.67 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 174.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.7 OUTLIER -81.94 138.7 34.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -177.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.8 tt -79.67 152.29 30.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.64 153.5 46.05 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.902 0.319 . . . . 0.0 110.665 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.33 166.33 33.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.784 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 43.1 t -155.92 160.03 39.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.91 0.884 . . . . 0.0 109.761 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -57.37 119.2 6.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.9 t -76.14 148.15 38.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -169.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.8 t -114.14 11.77 17.66 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 169.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.6 163.04 22.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.887 0.875 . . . . 0.0 111.942 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -93.53 -3.14 53.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.742 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -153.33 170.56 20.34 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.539 0.736 . . . . 0.0 110.752 -177.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.34 23.49 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.051 0.94 . . . . 0.0 109.873 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.369 -1.3 . . . . 0.0 110.61 -176.116 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.455 -0.776 0 N-CA-C 111.08 -0.392 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -156.01 156.51 34.56 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.796 0.439 . . . . 0.0 110.564 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.05 160.68 30.94 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.879 0.472 . . . . 0.0 111.034 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -73.78 -7.34 51.76 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 28.7 t -159.92 148.37 13.55 Favored Pre-proline 0 C--O 1.232 0.144 0 C-N-CA 122.924 0.489 . . . . 0.0 110.547 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.55 -16.01 46.19 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.26 2.64 . . . . 0.0 110.557 174.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -85.37 150.55 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.44 156.3 46.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.65 1.18 . . . . 0.0 108.563 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 45.6 tpp -137.48 135.72 37.08 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.208 -0.308 . . . . 0.0 111.082 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.17 152.0 34.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -176.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -138.78 177.9 7.55 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 9.89 82.2 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.896 -0.391 . . . . 0.0 112.255 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 44.4 mt -78.27 28.03 0.19 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.473 0.709 . . . . 0.0 111.851 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -64.89 -27.55 68.93 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -175.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.49 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.5 pm0 -79.16 150.91 31.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.006 0.431 . . . . 0.0 111.208 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.7 m -70.72 -5.83 32.77 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.02 -15.32 61.52 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 118.093 0.406 . . . . 0.0 111.921 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 71.3 mmm -95.13 147.08 23.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.196 0.453 . . . . 0.0 111.382 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -158.73 163.52 36.72 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.357 1.063 . . . . 0.0 108.508 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 86.8 m -54.28 -44.62 72.04 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.061 0.391 . . . . 0.0 110.857 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -68.01 -37.28 81.24 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -74.08 -48.39 30.07 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.09 -39.62 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 6.9 t80 -75.91 -31.91 59.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -71.05 -38.45 72.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.159 0.436 . . . . 0.0 110.198 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -61.82 -48.32 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 120.102 -0.639 . . . . 0.0 112.608 -176.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.523 2.5 p90 -76.6 -12.07 59.96 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 168.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.3 t -66.86 -24.79 66.18 Favored 'General case' 0 C--N 1.338 0.071 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . 0.436 HD21 ' HB3' ' A' ' 578' ' ' CYS . 0.5 OUTLIER -49.52 -37.16 25.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.242 0.617 . . . . 0.0 110.926 173.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -79.51 -14.86 58.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -176.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.16 -174.6 45.99 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 118.939 0.791 . . . . 0.0 112.946 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -73.54 124.88 26.73 Favored 'General case' 0 C--O 1.231 0.109 0 O-C-N 122.644 -0.327 . . . . 0.0 111.754 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.443 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.4 m -114.09 165.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.096 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 178.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -126.42 -59.51 1.3 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -146.58 166.18 27.27 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 118.852 0.751 . . . . 0.0 112.98 -173.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.28 148.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 124.472 1.109 . . . . 0.0 109.332 175.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -157.3 126.19 5.81 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.116 0.566 . . . . 0.0 111.042 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.92 153.87 38.41 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 36.4 mmt -86.62 117.03 25.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.308 0.643 . . . . 0.0 110.317 175.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -79.21 -15.77 57.55 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.425 -0.172 . . . . 0.0 111.4 171.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 32.5 t -90.15 -5.88 55.98 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -124.34 154.81 69.1 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 123.351 0.66 . . . . 0.0 109.836 -176.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.26 -17.06 40.03 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.412 2.741 . . . . 0.0 111.86 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.08 94.75 0.09 OUTLIER Glycine 0 C--N 1.336 0.536 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.41 163.01 35.84 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.537 0.735 . . . . 0.0 109.462 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.39 143.04 13.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 84.7 mtp -82.59 151.68 26.27 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.8 t -146.53 153.79 12.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . 0.413 ' C ' ' HG3' ' A' ' 423' ' ' MET . 79.8 tt0 -135.22 133.42 39.0 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.102 -0.374 . . . . 0.0 110.002 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . 0.413 ' HG3' ' C ' ' A' ' 422' ' ' GLU . 60.4 mtp -150.59 169.35 21.77 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.197 0.999 . . . . 0.0 109.461 -171.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.465 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.9 123.04 18.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 171.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.2 p30 -72.29 -33.55 67.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 -166.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.37 -89.62 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.33 -25.47 60.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.72 -32.68 16.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 118.735 -1.186 . . . . 0.0 112.208 -174.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.68 -24.31 6.09 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 C-N-CA 118.04 -1.464 . . . . 0.0 109.031 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -69.34 -47.78 63.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.785 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -63.7 -40.25 96.31 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.06 -36.72 85.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.464 0.574 . . . . 0.0 110.589 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.8 mt -81.73 -10.16 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 123.066 0.547 . . . . 0.0 111.706 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 52.8 m -102.26 -16.56 16.27 Favored 'General case' 0 N--CA 1.461 0.082 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -135.42 -19.74 1.65 Allowed 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -170.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 8.9 tp -134.57 -15.34 2.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -170.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 17.8 p-10 -71.38 101.0 2.28 Favored 'General case' 0 C--O 1.204 -1.31 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -169.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.7 m-80 78.2 21.98 0.82 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 123.988 3.085 . . . . 0.0 113.889 -161.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -76.05 159.76 30.48 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.331 -0.855 . . . . 0.0 110.713 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -78.12 138.78 38.9 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 174.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.8 ttt -159.23 135.81 9.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.793 0.437 . . . . 0.0 109.919 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.329 51.9 m-85 58.07 21.56 8.01 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.79 7.24 88.37 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -124.18 -167.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.365 1.466 . . . . 0.0 108.459 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -138.4 151.19 47.25 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.546 0.338 . . . . 0.0 110.534 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -130.42 87.66 2.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -56.26 129.47 40.42 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 115.541 -2.171 . . . . 0.0 111.594 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.447 1.9 t -125.88 149.45 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 113.531 -3.268 . . . . 0.0 116.353 168.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 42.0 t -159.54 165.97 31.81 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.778 1.231 . . . . 0.0 108.166 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -71.38 148.63 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 22.2 t -85.34 161.98 19.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.017 0.527 . . . . 0.0 110.851 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -106.74 -0.23 23.7 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 117.515 0.143 . . . . 0.0 110.914 177.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -82.01 151.55 67.15 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.53 0.732 . . . . 0.0 110.317 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -77.43 -35.88 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.257 2.638 . . . . 0.0 112.208 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.76 158.84 9.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.352 0.661 . . . . 0.0 110.583 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.4 mt -79.96 146.71 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 81.9 mtp -119.25 130.14 25.01 Favored Pre-proline 0 N--CA 1.454 -0.253 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.87 163.81 34.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.632 2.888 . . . . 0.0 110.122 176.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.03 -125.04 1.71 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -72.43 166.62 22.21 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.948 0.499 . . . . 0.0 111.239 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 34.3 t -157.81 165.73 34.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.615 0.766 . . . . 0.0 109.773 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -125.62 -1.61 7.39 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.79 -178.8 51.83 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.005 0.336 . . . . 0.0 112.488 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 90.5 mt -143.77 160.53 40.56 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.964 0.906 . . . . 0.0 109.769 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.51 -12.0 61.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.752 0.421 . . . . 0.0 111.647 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -120.48 20.74 11.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.175 0.59 . . . . 0.0 110.29 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -169.77 -153.37 8.52 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.2 m -132.92 -15.44 2.63 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.2 t -127.06 146.25 50.43 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.753 0.421 . . . . 0.0 110.117 176.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.7 p -93.82 10.5 32.88 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.415 0.686 . . . . 0.0 110.874 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -135.61 147.92 48.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -156.77 154.24 29.63 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-O 120.704 0.288 . . . . 0.0 110.375 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 0.4 OUTLIER -132.63 140.19 48.09 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.888 0.875 . . . . 0.0 113.148 179.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.291 15.8 m-85 -111.03 8.61 21.96 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 117.638 2.458 . . . . 0.0 117.638 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.2 t -71.67 -28.68 63.9 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -92.5 -18.66 22.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.919 0.888 . . . . 0.0 111.289 178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 75.0 m -76.59 -17.78 59.01 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.93 2.24 0.97 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.66 1.184 . . . . 0.0 114.103 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -62.74 -15.4 53.05 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.462 -0.774 . . . . 0.0 112.862 -178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.21 124.62 17.58 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.81 0.444 . . . . 0.0 110.976 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -72.81 -33.52 66.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.62 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.328 57.9 m-85 -98.02 17.27 18.75 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.2 t -61.76 -22.11 65.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.413 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -136.48 152.05 74.1 Favored Pre-proline 0 C--N 1.339 0.134 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -178.073 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 31.3 Cg_exo -63.68 -31.73 69.25 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.249 2.632 . . . . 0.0 112.43 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -78.86 -21.74 47.08 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 117.689 0.222 . . . . 0.0 111.091 -178.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -80.66 -41.95 22.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.84 -20.02 64.66 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.633 0.373 . . . . 0.0 111.912 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.42 -20.41 47.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.04 2.59 8.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -61.99 155.76 22.94 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.315 0.507 . . . . 0.0 111.934 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 18.4 mtt180 -141.92 131.57 24.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.5 mm -139.65 145.11 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 123.723 0.809 . . . . 0.0 109.001 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -158.29 159.22 35.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.152 0.581 . . . . 0.0 109.455 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -60.51 158.61 29.06 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -61.35 146.1 97.6 Favored 'Trans proline' 0 N--CA 1.451 -1.026 0 C-N-CA 122.292 1.995 . . . . 0.0 109.946 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -153.7 171.47 18.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -175.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -83.65 -7.88 59.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 1.9 t -85.46 141.92 13.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 174.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 11.7 tp -139.9 150.94 45.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.515 0.326 . . . . 0.0 110.209 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -125.01 150.06 47.1 Favored 'General case' 0 C--N 1.334 -0.106 0 C-N-CA 124.05 0.94 . . . . 0.0 108.848 -177.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -139.63 159.26 42.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.294 0.568 . . . . 0.0 111.952 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -150.42 166.34 30.39 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.3 m120 54.42 57.16 6.06 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.341 0.257 . . . . 0.0 111.215 -175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -129.34 150.61 76.02 Favored Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 122.455 0.302 . . . . 0.0 110.929 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.421 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 52.2 Cg_exo -55.96 156.51 19.5 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.703 2.936 . . . . 0.0 113.014 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.27 -16.68 64.05 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.461 0.704 . . . . 0.0 111.058 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -122.67 24.3 9.2 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.89 0.876 . . . . 0.0 110.831 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.0 p -63.3 -13.16 12.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -55.37 -177.6 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 117.977 -1.011 . . . . 0.0 113.556 -165.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.672 ' H ' HG22 ' A' ' 510' ' ' THR . 22.8 pt-20 -21.29 -41.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -170.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.3 mt-10 -56.1 -48.75 75.54 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 117.413 -1.28 . . . . 0.0 114.413 172.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -87.07 -26.07 23.87 Favored 'General case' 0 C--N 1.35 0.61 0 CA-C-N 122.474 2.397 . . . . 0.0 106.886 -173.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -66.98 -38.22 85.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -73.39 -40.27 64.46 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -76.07 -22.82 55.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.483 -177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 55.8 mt -77.08 -45.31 30.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-N 118.417 0.553 . . . . 0.0 110.924 178.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 28.4 p -71.81 -27.58 63.02 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.599 -178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -71.7 -36.77 70.65 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.792 0.33 . . . . 0.0 111.499 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.61 -28.77 66.22 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.388 0.275 . . . . 0.0 111.307 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 91.4 mt -94.85 -5.63 44.59 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.658 0.383 . . . . 0.0 111.569 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.86 1.61 62.84 Favored Glycine 0 CA--C 1.531 1.052 0 CA-C-O 119.584 -0.564 . . . . 0.0 113.119 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.3 m -76.91 163.65 3.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 118.18 0.99 . . . . 0.0 112.941 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.43 144.97 53.22 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -83.43 144.18 45.86 Favored Pre-proline 0 N--CA 1.455 -0.215 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.154 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -70.17 151.61 66.82 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.303 2.668 . . . . 0.0 110.839 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -95.51 -17.61 21.31 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 176.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 27.8 t -152.42 159.79 43.35 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-O 120.597 0.237 . . . . 0.0 111.031 175.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 7.5 p -155.27 150.1 11.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 C-N-CA 123.184 0.593 . . . . 0.0 110.267 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -150.53 144.06 25.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.465 1.106 . . . . 0.0 108.8 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.21 151.94 31.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -156.61 -173.27 4.4 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -178.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 90.8 p -140.42 -177.47 5.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.011 0.924 . . . . 0.0 110.376 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.26 -8.97 62.91 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 123.839 0.733 . . . . 0.0 112.223 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.32 -28.26 21.15 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.95 0.875 . . . . 0.0 111.437 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.5 t -166.4 159.71 14.92 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.26 0.624 . . . . 0.0 110.057 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.08 -7.83 31.79 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.631 0.372 . . . . 0.0 110.296 175.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -79.77 -30.52 40.73 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.8 p -164.91 168.7 17.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.196 0.522 . . . . 0.0 112.057 -173.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 40.6 t -82.82 166.93 18.57 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.756 0.823 . . . . 0.0 110.325 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 62.7 m -142.65 159.23 42.64 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.349 1.06 . . . . 0.0 108.405 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.47 -174.16 46.66 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 119.834 -1.175 . . . . 0.0 113.415 -179.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.24 160.27 22.5 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.691 0.796 . . . . 0.0 110.699 -177.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 87.6 mt -142.03 162.47 35.41 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.572 1.549 . . . . 0.0 108.198 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -152.32 148.69 27.82 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.26 -0.275 . . . . 0.0 110.907 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 10.5 m-90 -126.41 175.27 7.99 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 125.228 1.411 . . . . 0.0 112.624 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -75.59 -9.78 58.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 42.0 t -161.38 158.09 26.31 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 122.852 0.461 . . . . 0.0 110.635 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.0 -21.01 63.26 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.361 0.264 . . . . 0.0 111.13 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.3 p -80.69 -24.83 38.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 117.929 0.331 . . . . 0.0 110.65 177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -76.26 -34.16 59.16 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.16 -26.29 59.01 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 175.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.1 tp -77.41 -35.75 53.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.726 0.41 . . . . 0.0 110.882 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.97 -37.58 75.82 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.9 m -72.77 -30.21 63.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -63.48 -33.83 76.44 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.0 -56.58 17.67 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 14.3 m-85 -82.38 -16.89 47.48 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -175.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.74 -13.95 14.91 Favored 'General case' 0 C--N 1.338 0.08 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -73.68 142.3 46.41 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.894 1.225 . . . . 0.0 108.995 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 60.67 10.55 2.67 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.49 1.116 . . . . 0.0 112.967 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 33.6 t80 -73.48 141.47 46.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -73.02 142.48 47.69 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . 0.421 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 78.4 mtm -83.58 152.33 24.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.316 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 62.1 pttt . . . . . 0 CA--C 1.53 0.191 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.335 -176.823 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 CA--C 1.529 0.164 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.76 154.51 67.64 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 123.126 2.551 . . . . 0.0 111.704 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -130.01 142.45 50.63 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 102.887 -3.005 . . . . 0.0 102.887 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 145.87 50.85 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 116.064 1.876 . . . . 0.0 116.064 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.4 tt -100.96 153.95 19.09 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.891 1.276 . . . . 0.0 108.378 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.8 155.42 44.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 120.982 0.42 . . . . 0.0 111.042 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.44 162.91 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.57 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . 0.436 ' HB3' HD21 ' A' ' 402' ' ' LEU . 17.0 p -159.24 164.86 34.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.473 0.709 . . . . 0.0 111.442 -172.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -56.53 123.51 15.06 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.1 t -77.43 145.65 37.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.268 0.8 OUTLIER -110.86 9.09 22.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 169.802 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.47 164.23 19.25 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.957 0.903 . . . . 0.0 111.112 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -90.75 1.31 56.99 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.939 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -177.41 176.58 1.29 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.531 1.132 . . . . 0.0 109.856 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -138.96 20.05 2.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.967 0.507 . . . . 0.0 111.226 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.248 -179.406 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.453 -0.865 0 N-CA-C 110.847 -0.482 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -149.3 156.87 42.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.988 0.423 . . . . 0.0 110.74 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.58 162.39 29.27 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.901 0.48 . . . . 0.0 111.164 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -72.64 -8.0 53.13 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -178.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -159.64 148.53 14.02 Favored Pre-proline 0 N--CA 1.455 -0.221 0 C-N-CA 122.635 0.374 . . . . 0.0 110.948 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.57 -19.29 44.17 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.697 2.931 . . . . 0.0 111.56 172.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.79 148.56 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.0 tt -132.67 152.83 51.58 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.981 1.313 . . . . 0.0 108.372 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -135.96 132.44 36.39 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -175.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.38 153.6 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -143.85 166.14 25.75 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 104.778 -2.304 . . . . 0.0 104.778 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 91.62 11.3 60.82 Favored Glycine 0 CA--C 1.529 0.914 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 54.3 mt -81.19 35.11 0.38 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.934 0.894 . . . . 0.0 110.91 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.292 8.5 p30 -81.65 25.21 0.54 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -171.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -134.45 157.79 45.56 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 123.042 0.537 . . . . 0.0 110.684 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -69.08 -11.53 60.87 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.65 0.78 . . . . 0.0 112.962 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -80.31 -9.25 59.73 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.5 0.32 . . . . 0.0 111.563 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 61.6 mmm -96.23 144.26 26.59 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 118.021 0.373 . . . . 0.0 110.273 -177.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -159.51 153.22 22.86 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.5 p -58.54 -30.23 66.94 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -72.05 -41.84 66.99 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 177.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 84.6 mtt-85 -75.99 -44.97 37.06 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.731 0.301 . . . . 0.0 111.245 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.29 -41.73 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -174.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -73.63 -41.14 63.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . 0.495 ' HA ' ' SG ' ' A' ' 401' ' ' CYS . 3.9 p30 -66.56 -31.13 71.64 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.696 -0.802 . . . . 0.0 109.269 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.84 -60.77 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 107.186 -1.412 . . . . 0.0 107.186 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.481 0.6 OUTLIER -76.61 -20.48 56.7 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 118.936 2.939 . . . . 0.0 118.936 177.765 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 398' ' ' ASN . 2.8 p -81.64 -19.26 42.13 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.07 0.85 . . . . 0.0 111.139 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . 0.411 ' C ' HD12 ' A' ' 402' ' ' LEU . 3.5 pp -61.29 -15.2 32.88 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.978 0.808 . . . . 0.0 111.107 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -76.46 -8.12 56.51 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -171.14 -147.57 5.69 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 -175.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -88.22 159.88 17.95 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.712 0.405 . . . . 0.0 110.965 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.469 HG22 ' HB3' ' A' ' 480' ' ' ASN . 1.7 m -114.17 154.07 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -176.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -144.77 -74.66 0.24 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -149.05 167.58 25.48 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 -172.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 4.3 p -154.81 147.28 13.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 124.794 1.237 . . . . 0.0 108.551 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -157.04 133.37 9.81 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -81.39 168.32 18.49 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.942 1.83 . . . . 0.0 115.942 177.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 50.5 mtt -130.89 128.18 40.03 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-O 120.9 0.381 . . . . 0.0 111.6 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . 0.4 ' HG3' ' H ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.2 -5.94 55.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.832 0.853 . . . . 0.0 112.341 175.145 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.5 p -83.32 -7.25 59.61 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.331 0.652 . . . . 0.0 112.451 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.08 157.55 77.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 C-N-CA 123.86 0.864 . . . . 0.0 109.422 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.93 -14.25 43.0 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.26 2.64 . . . . 0.0 111.235 177.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.74 98.67 0.11 Allowed Glycine 0 C--N 1.338 0.645 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 175.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.84 158.17 36.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.36 0.664 . . . . 0.0 109.492 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.39 150.85 23.9 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.275 0.559 . . . . 0.0 112.231 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 34.6 ttm -96.57 151.8 19.25 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.559 1.144 . . . . 0.0 108.313 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 37.9 t -144.85 154.28 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -142.42 135.8 28.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 71.7 mtm -160.45 177.58 10.42 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.355 1.462 . . . . 0.0 108.987 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.61 125.5 24.47 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 171.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -72.3 -33.57 67.5 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.34 -84.43 0.04 OUTLIER Glycine 0 C--N 1.333 0.413 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -73.52 -29.32 62.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.25 -35.14 18.67 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.431 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.43 -24.96 6.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.311 0 C-N-CA 118.916 -1.114 . . . . 0.0 109.828 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -70.33 -50.37 39.85 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.46 174.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -64.32 -36.05 82.86 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.623 -0.673 . . . . 0.0 112.032 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.63 -34.57 78.53 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.005 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -80.62 -8.04 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.528 0.731 . . . . 0.0 111.141 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 7.1 m -100.37 -18.87 16.56 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 176.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -131.89 -21.34 2.44 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -170.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 86.7 mt -134.43 -14.37 2.25 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.0 p-10 -71.65 100.86 2.39 Favored 'General case' 0 C--O 1.205 -1.285 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -170.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.525 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 22.7 m-80 77.07 21.94 1.06 Allowed 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 124.11 3.141 . . . . 0.0 112.526 -159.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -87.65 154.95 20.19 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 168.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -78.33 140.58 38.78 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -154.87 134.63 12.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.198 0.599 . . . . 0.0 110.272 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.388 48.4 m-85 59.43 19.09 7.44 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.93 10.73 62.46 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 120.017 -0.324 . . . . 0.0 112.446 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -146.14 150.18 35.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 117.411 0.606 . . . . 0.0 110.405 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -84.94 149.69 25.46 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.253 -0.279 . . . . 0.0 110.928 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -131.37 92.43 3.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.983 0.513 . . . . 0.0 109.636 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.525 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 21.5 t-20 -58.51 130.7 48.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 115.877 -2.011 . . . . 0.0 112.048 -171.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.451 2.2 t -124.88 149.7 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 113.46 -3.296 . . . . 0.0 116.416 168.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 34.4 t -161.39 172.91 15.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.162 1.385 . . . . 0.0 108.302 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.92 145.7 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 30.2 t -85.55 157.93 20.27 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 122.744 0.418 . . . . 0.0 110.877 177.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -96.57 -4.32 41.46 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.435 -0.166 . . . . 0.0 110.777 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -78.95 152.15 76.84 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.736 0.814 . . . . 0.0 111.111 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.13 -34.81 1.04 Allowed 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.56 2.84 . . . . 0.0 112.068 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.28 159.76 10.97 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 122.961 0.504 . . . . 0.0 111.107 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.3 mt -78.27 136.7 23.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 61.4 mmm -103.59 125.12 35.7 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 122.311 0.244 . . . . 0.0 110.975 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -78.16 173.31 14.1 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.904 3.07 . . . . 0.0 110.187 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 128.52 -108.57 0.92 Allowed Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -72.42 153.17 41.56 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.349 0.659 . . . . 0.0 110.679 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.2 p -159.04 175.22 13.8 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.28 0.632 . . . . 0.0 110.095 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -143.33 163.82 31.97 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.91 135.11 14.5 Favored Glycine 0 CA--C 1.525 0.659 0 O-C-N 122.099 -0.376 . . . . 0.0 112.66 -174.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.34 165.58 14.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.253 0.621 . . . . 0.0 109.516 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -72.7 -19.54 61.38 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.162 -0.336 . . . . 0.0 111.732 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -120.52 24.9 10.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.088 0.555 . . . . 0.0 109.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.2 -159.62 13.08 Favored Glycine 0 C--N 1.337 0.631 0 O-C-N 121.715 -0.616 . . . . 0.0 111.817 -177.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.5 t -133.09 -17.86 2.36 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.8 t -127.1 143.53 51.25 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.73 0.412 . . . . 0.0 110.04 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.6 p -86.74 1.59 51.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 123.168 0.587 . . . . 0.0 111.809 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.258 19.6 t80 -128.57 145.72 51.05 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 115.634 1.716 . . . . 0.0 115.634 -178.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -153.61 149.5 27.66 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.857 0.463 . . . . 0.0 109.952 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.251 0.1 OUTLIER -130.2 140.87 50.69 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 179.006 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . 0.408 ' HB3' HG21 ' A' ' 406' ' ' VAL 0.267 65.7 m-85 -111.75 -2.43 15.3 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -178.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 44.7 t -73.59 -26.31 60.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.13 14.99 2.06 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.699 0.8 . . . . 0.0 111.028 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 48.3 t -137.24 169.23 18.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.604 0.762 . . . . 0.0 110.56 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.04 6.49 31.2 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.111 0.565 . . . . 0.0 111.569 -176.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -62.06 -18.5 60.85 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . 0.469 ' HB3' HG22 ' A' ' 406' ' ' VAL . 0.4 OUTLIER -59.08 117.92 5.25 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.098 0.559 . . . . 0.0 111.657 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -81.17 -33.59 32.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.277 62.3 m-85 -97.94 3.5 49.6 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -176.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 57.8 m -87.76 7.0 32.32 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -172.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.448 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.77 144.46 53.0 Favored Pre-proline 0 C--O 1.231 0.1 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 177.278 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.0 Cg_exo -64.66 -29.58 60.36 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.024 2.482 . . . . 0.0 112.372 -178.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -81.33 -26.4 35.66 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.667 -0.206 . . . . 0.0 111.18 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -82.25 -42.35 19.01 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.29 0.496 . . . . 0.0 110.906 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.35 -16.45 54.52 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.97 -21.52 33.98 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -124.04 4.13 8.64 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -64.02 155.44 31.14 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.779 0.718 . . . . 0.0 111.493 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -144.06 126.21 15.56 Favored 'General case' 0 N--CA 1.458 -0.062 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -174.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.8 mm -148.63 123.25 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 C-N-CA 124.351 1.06 . . . . 0.0 108.324 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -162.1 97.68 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.901 0.318 . . . . 0.0 110.781 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 496' ' ' PRO . 15.1 p80 54.32 155.13 0.05 OUTLIER Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 127.501 2.32 . . . . 0.0 114.596 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 495' ' ' HIS . 91.5 Cg_endo -75.7 76.2 3.75 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.536 2.824 . . . . 0.0 109.837 176.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.1 t -65.01 161.0 19.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.129 0.572 . . . . 0.0 110.856 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -83.84 -7.41 59.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 5.0 t -85.32 148.7 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.952 0.901 . . . . 0.0 110.8 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 10.2 tp -136.59 151.57 49.5 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -123.25 146.21 48.04 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -140.13 155.64 46.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.459 0.647 . . . . 0.0 109.34 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -148.44 163.77 36.15 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 104.423 -2.436 . . . . 0.0 104.423 -174.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 60.94 57.23 2.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.733 0.813 . . . . 0.0 112.044 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -137.39 137.09 21.42 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.945 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -49.83 159.91 1.42 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.863 3.042 . . . . 0.0 113.038 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . 0.559 HD12 ' H ' ' A' ' 507' ' ' LEU . 2.9 mp -68.52 -16.5 63.9 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -173.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.6 19.93 11.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 15.2 m -71.55 5.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.67 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.8 OUTLIER -54.88 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 117.497 -1.24 . . . . 0.0 113.223 -167.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.67 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -23.64 -37.29 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -171.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 92.9 mt-10 -56.85 -49.74 74.56 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 117.416 -1.278 . . . . 0.0 114.009 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -85.1 -25.75 27.34 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 122.286 2.312 . . . . 0.0 106.69 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -65.87 -38.37 88.61 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -74.44 -42.12 59.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.47 -24.64 59.07 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.094 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -74.48 -38.68 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.27 0.486 . . . . 0.0 109.983 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 93.5 m -67.41 -36.61 81.61 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 122.023 -0.423 . . . . 0.0 110.863 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -69.62 -29.18 66.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -76.58 -27.36 55.81 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 122.15 0.18 . . . . 0.0 111.186 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 80.1 mt -96.07 -6.06 39.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.893 0.477 . . . . 0.0 111.62 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.47 -8.57 25.81 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-O 119.472 -0.627 . . . . 0.0 113.195 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 m -76.92 155.37 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 118.384 1.092 . . . . 0.0 112.022 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -68.54 151.12 47.22 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.297 0.57 . . . . 0.0 112.024 -173.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -71.94 155.04 92.4 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.984 0.913 . . . . 0.0 111.286 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.24 155.1 65.12 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.387 2.725 . . . . 0.0 110.949 175.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -88.38 -20.57 25.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 14.1 t -153.91 164.03 39.08 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 110.994 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 3.1 p -160.34 146.81 5.93 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 C-N-CA 123.119 0.568 . . . . 0.0 109.469 -176.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -143.23 137.8 29.2 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.166 0.986 . . . . 0.0 108.929 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.2 146.99 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.343 0.657 . . . . 0.0 110.834 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -155.38 174.84 14.66 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 -173.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 80.8 p -62.93 134.78 56.73 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.503 0.668 . . . . 0.0 110.347 177.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -70.84 163.96 53.49 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.502 -175.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -81.05 12.13 3.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.411 1.084 . . . . 0.0 111.5 177.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 30.2 t -155.38 -172.73 4.27 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.335 1.054 . . . . 0.0 108.968 -177.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.85 -7.88 32.36 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -89.55 110.4 21.25 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.428 0.691 . . . . 0.0 110.593 172.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 68.2 m 53.6 -163.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.882 0.873 . . . . 0.0 112.954 174.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 20.7 m -140.8 178.49 7.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.523 1.129 . . . . 0.0 110.896 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.8 m -137.6 168.56 19.42 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . -174.88 179.32 46.26 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.669 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -121.75 158.4 28.87 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.729 0.812 . . . . 0.0 109.864 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.1 mt -141.26 166.7 24.05 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 124.728 1.211 . . . . 0.0 109.385 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -153.85 150.74 28.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.193 -0.317 . . . . 0.0 110.708 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 20.8 m-90 -130.54 165.52 22.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.792 1.237 . . . . 0.0 111.638 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -68.17 -7.04 26.63 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.2 t -160.13 160.92 33.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.559 0.344 . . . . 0.0 110.794 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -67.46 -27.96 67.47 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 177.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.0 m -76.95 -26.58 54.18 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.462 0.305 . . . . 0.0 110.727 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.19 -36.89 66.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 177.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.95 -24.55 52.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 175.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.9 tp -78.79 -36.81 42.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.895 0.478 . . . . 0.0 111.481 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -75.22 -38.73 60.55 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.85 -24.41 64.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.33 -33.7 73.52 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.42 -27.03 73.26 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.34 9.1 m-85 -100.31 -6.11 26.39 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 118.961 2.949 . . . . 0.0 118.961 177.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.6 mt -123.9 -9.42 7.76 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -73.36 139.69 46.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.838 1.199 . . . . 0.0 109.356 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 56.19 17.44 2.76 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.311 1.045 . . . . 0.0 112.719 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -70.32 138.94 51.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -74.42 129.55 37.98 Favored 'General case' 0 N--CA 1.455 -0.185 0 O-C-N 122.195 -0.315 . . . . 0.0 111.083 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.9 mtm -83.53 152.45 24.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.569 0.223 . . . . 0.0 111.122 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 64.4 pttt . . . . . 0 CA--C 1.532 0.269 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.933 178.524 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.262 4.7 p90 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.4 157.06 57.51 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.588 2.859 . . . . 0.0 112.264 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.87 142.46 50.66 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 102.807 -3.035 . . . . 0.0 102.807 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -73.35 137.56 44.81 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -86.3 138.25 31.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.928 1.291 . . . . 0.0 108.145 175.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.99 146.57 50.62 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.597 0.635 . . . . 0.0 110.458 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.3 161.29 39.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.091 0.472 . . . . 0.0 111.281 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.53 172.14 14.85 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.039 0.935 . . . . 0.0 110.166 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -54.99 121.96 9.85 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 32.1 t -78.65 152.33 31.75 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.4 t -118.61 10.64 12.59 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 170.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.33 162.49 14.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.47 0.652 . . . . 0.0 111.867 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -82.99 8.88 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.894 0.878 . . . . 0.0 112.741 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -160.2 178.11 9.98 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.475 0.579 . . . . 0.0 111.31 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.51 12.43 1.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.085 0.954 . . . . 0.0 110.112 169.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.39 -1.29 . . . . 0.0 110.401 -176.391 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 N--CA 1.454 -0.805 0 N-CA-C 110.84 -0.485 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -147.3 153.37 39.65 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 122.836 0.455 . . . . 0.0 110.719 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -76.28 159.47 30.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.767 0.427 . . . . 0.0 110.714 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -82.44 1.48 37.3 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.4 t -157.77 145.38 13.72 Favored Pre-proline 0 N--CA 1.456 -0.174 0 C-N-CA 122.83 0.452 . . . . 0.0 110.69 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.54 -15.05 41.04 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.661 2.907 . . . . 0.0 110.676 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 t -88.93 149.0 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.57 155.88 47.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.253 1.021 . . . . 0.0 108.429 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.1 tpt -139.37 133.76 31.55 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 122.01 -0.431 . . . . 0.0 110.808 -174.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.16 153.53 37.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -139.48 166.45 24.53 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 90.68 9.48 64.37 Favored Glycine 0 CA--C 1.529 0.954 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.659 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.8 mt -78.1 25.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.77 0.785 . . . . 0.0 112.483 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -67.49 -15.57 63.74 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -72.21 155.36 40.31 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.644 -0.66 . . . . 0.0 111.958 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.8 p -68.72 -9.17 48.98 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 123.591 0.756 . . . . 0.0 111.328 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -95.63 5.08 52.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.723 0.809 . . . . 0.0 111.254 -173.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 59.1 mmm -106.33 138.14 43.04 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -177.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -160.18 157.98 29.3 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.443 0.697 . . . . 0.0 109.863 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 92.9 m -52.27 -41.76 63.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.58 0.352 . . . . 0.0 111.668 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -72.17 -36.51 69.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -76.02 -47.25 25.58 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -174.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 18.6 t -69.75 -40.78 79.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.404 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 3.6 t80 -78.27 -31.34 49.01 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.009 -170.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -74.66 -31.05 61.81 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 119.897 1.226 . . . . 0.0 109.84 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.78 -56.48 17.58 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.556 2.3 p90 -76.55 -3.79 39.36 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 174.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 35.7 t -75.05 -35.11 61.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 122.07 -0.394 . . . . 0.0 111.357 177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.4 -15.46 36.85 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -80.69 -7.18 59.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.91 2.189 . . . . 0.0 116.91 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -179.54 -130.64 1.49 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 118.289 0.495 . . . . 0.0 111.963 -175.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -136.49 124.15 22.38 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.404 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.4 m -114.02 165.46 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -174.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -118.04 -61.49 1.67 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . 0.402 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 19.4 pttm -154.38 166.16 34.09 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.5 p -145.57 152.03 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 C-N-CA 124.604 1.162 . . . . 0.0 109.828 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -155.62 131.84 10.16 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.254 3.3 m-85 -82.73 164.03 20.92 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 116.871 2.175 . . . . 0.0 116.871 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.8 mmt -106.7 120.4 41.89 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.336 0.654 . . . . 0.0 112.44 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -79.1 -20.52 48.5 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.625 0.77 . . . . 0.0 111.31 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 42.3 t -81.45 -19.51 42.25 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.061 0.545 . . . . 0.0 112.355 -175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -115.64 157.87 43.28 Favored Pre-proline 0 N--CA 1.456 -0.156 0 C-N-CA 123.371 0.669 . . . . 0.0 109.759 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 -18.55 55.9 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.712 2.275 . . . . 0.0 110.791 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.64 103.82 0.17 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 176.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.36 162.37 33.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.802 0.841 . . . . 0.0 109.194 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.13 147.0 16.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 112.067 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 80.2 mtp -90.02 152.82 21.0 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.308 170.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.63 152.56 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 123.603 0.761 . . . . 0.0 110.228 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -136.31 130.35 32.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.595 0.634 . . . . 0.0 109.84 175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.0 mtp -151.0 171.22 17.63 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.449 0.7 . . . . 0.0 109.14 -169.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.52 123.27 19.2 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -72.61 -33.43 66.67 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -167.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.9 -88.66 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -72.27 -26.47 62.0 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -175.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.15 -34.23 15.94 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.265 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.18 -24.44 6.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 118.096 -1.442 . . . . 0.0 109.155 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -67.6 -50.41 58.38 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.527 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -65.18 -38.88 91.9 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.53 -37.51 85.17 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.785 0.72 . . . . 0.0 109.987 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 57.8 mt -77.45 -9.08 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.453 0.701 . . . . 0.0 111.713 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 76.7 m -102.85 -15.52 16.19 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -133.11 -24.81 1.84 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 -169.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.5 mp -133.98 -12.33 2.55 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.385 1.448 . . . . 0.0 113.329 -172.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -70.97 101.15 2.12 Favored 'General case' 0 C--O 1.206 -1.208 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -169.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.1 m-80 77.1 22.07 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 124.518 3.326 . . . . 0.0 113.669 -161.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.12 162.94 20.1 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 167.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -81.21 138.61 35.8 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.3 ttt -153.74 137.85 16.45 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.46 0.704 . . . . 0.0 109.71 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.5 m-85 57.46 21.53 7.07 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.95 7.33 66.15 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.44 -0.644 . . . . 0.0 113.089 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -149.91 154.27 38.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.03 0.915 . . . . 0.0 110.579 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -73.96 146.21 44.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.996 0.518 . . . . 0.0 111.818 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -125.12 84.45 2.28 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.243 1.017 . . . . 0.0 108.814 175.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.5 m120 -55.16 128.39 33.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.756 -170.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.0 t -126.99 149.0 31.76 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 C-N-CA 113.486 -3.286 . . . . 0.0 115.848 168.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.6 t -160.28 170.7 20.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.554 1.542 . . . . 0.0 107.763 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.1 148.87 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 20.6 t -83.36 166.47 18.41 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 122.983 0.513 . . . . 0.0 110.634 177.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.86 11.69 10.41 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -85.15 152.84 59.14 Favored Pre-proline 0 CA--C 1.532 0.259 0 C-N-CA 123.46 0.704 . . . . 0.0 110.22 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -65.49 -46.57 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.888 2.392 . . . . 0.0 112.468 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -170.02 160.29 8.13 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.902 0.881 . . . . 0.0 109.751 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.402 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 69.8 mt -77.91 143.08 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.2 mtp -114.16 134.12 22.26 Favored Pre-proline 0 N--CA 1.454 -0.236 0 O-C-N 122.407 -0.183 . . . . 0.0 111.033 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.38 161.47 40.17 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.497 2.798 . . . . 0.0 109.282 174.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 159.76 -132.15 2.91 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -72.47 161.79 30.34 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.892 0.477 . . . . 0.0 110.021 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.0 p -149.3 168.78 22.4 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.341 0.656 . . . . 0.0 110.03 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -129.34 -1.25 5.05 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.49 -178.95 46.98 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 -178.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.79 159.43 42.88 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.162 0.985 . . . . 0.0 109.453 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -76.7 -9.28 58.56 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -120.62 24.93 10.05 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.611 0.764 . . . . 0.0 110.249 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.89 -152.97 9.34 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.0 m -133.01 -12.67 2.85 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 178.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 19.4 p -127.04 150.86 49.25 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.274 0.63 . . . . 0.0 111.924 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.2 p -99.8 4.74 45.44 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.334 0.653 . . . . 0.0 110.884 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -141.6 148.24 38.91 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.374 1.47 . . . . 0.0 113.574 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -151.08 156.15 40.45 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 118.274 0.488 . . . . 0.0 111.291 -176.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -127.96 137.08 52.12 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -129.92 -1.78 4.69 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -68.22 -30.59 69.69 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.643 0.377 . . . . 0.0 111.749 -174.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -91.19 -2.72 57.45 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.683 0.393 . . . . 0.0 111.418 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 46.3 t -96.3 151.31 19.64 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.821 0.449 . . . . 0.0 111.927 -176.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -90.97 5.3 49.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.874 0.47 . . . . 0.0 111.183 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.05 -22.3 65.64 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.678 0.391 . . . . 0.0 111.656 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -60.71 137.7 58.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.905 0.482 . . . . 0.0 109.917 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 481' ' ' ARG . 48.7 tpt85 -72.12 -24.75 61.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.16 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.269 51.8 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 88.6 p -61.19 -22.16 64.49 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -169.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.59 157.72 67.44 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.48 -23.8 75.11 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.876 2.384 . . . . 0.0 111.298 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -80.96 -31.78 34.7 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -76.97 -28.11 55.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -73.45 -21.38 60.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 122.652 0.381 . . . . 0.0 110.72 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.9 -12.97 58.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.879 0.472 . . . . 0.0 111.895 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -123.97 16.53 9.3 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.966 0.507 . . . . 0.0 110.676 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 149.17 48.58 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 111.41 -174.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -145.6 130.46 18.17 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 30.1 mm -140.53 137.54 36.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 122.777 0.431 . . . . 0.0 110.153 -175.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -152.26 167.42 28.66 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.44 1.096 . . . . 0.0 109.624 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -64.74 157.61 73.38 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.63 148.61 92.63 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.37 2.047 . . . . 0.0 109.584 178.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -152.46 174.72 13.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -83.82 -7.66 59.4 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -86.76 140.24 16.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 112.328 173.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 14.4 tp -137.56 142.72 41.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -112.32 150.93 30.33 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.783 0.833 . . . . 0.0 109.406 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -146.46 160.22 42.37 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.456 0.646 . . . . 0.0 109.646 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -151.63 167.55 27.77 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 32.8 m120 53.28 55.71 8.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.612 0.365 . . . . 0.0 111.427 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.22 152.85 52.92 Favored Pre-proline 0 CA--C 1.531 0.217 0 C-N-CA 122.323 0.249 . . . . 0.0 110.454 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.15 152.4 38.06 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.152 2.568 . . . . 0.0 112.157 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.78 -16.4 63.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.97 0.508 . . . . 0.0 112.203 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -122.06 24.62 9.45 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.615 0.766 . . . . 0.0 110.897 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.74 -13.23 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 -176.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.682 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.3 -178.37 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -166.484 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.682 ' H ' HG22 ' A' ' 510' ' ' THR . 23.0 pt-20 -20.23 -42.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.6 mt-10 -56.15 -49.24 74.52 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 172.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -87.17 -27.04 23.26 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 122.034 2.197 . . . . 0.0 106.732 -173.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -64.95 -39.92 94.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -70.53 -44.42 67.55 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -75.31 -26.56 58.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.085 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.3 mt -71.6 -37.38 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.044 0 CA-C-N 118.858 0.754 . . . . 0.0 110.203 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 94.5 m -67.3 -29.97 69.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.897 -0.502 . . . . 0.0 111.026 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -73.85 -28.98 61.86 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -78.36 -11.51 59.95 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.98 -4.88 12.52 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.173 0.589 . . . . 0.0 111.55 -179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.8 3.87 60.57 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 123.572 0.606 . . . . 0.0 112.82 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.94 157.13 5.46 Favored 'Isoleucine or valine' 0 C--N 1.339 0.129 0 CA-C-N 117.831 0.815 . . . . 0.0 112.813 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.53 144.5 55.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.575 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 55.3 ptt85 -80.81 149.43 67.32 Favored Pre-proline 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.63 148.3 65.57 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 123.058 2.505 . . . . 0.0 110.311 177.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.7 t -85.64 -21.01 28.62 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -146.84 154.64 41.57 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 122.978 0.511 . . . . 0.0 110.786 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 76.8 t -144.72 145.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 123.649 0.779 . . . . 0.0 109.913 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -152.85 143.63 22.85 Favored 'General case' 0 C--N 1.337 0.049 0 C-N-CA 123.002 0.521 . . . . 0.0 109.994 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -138.62 150.64 23.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.057 0 C-N-CA 123.43 0.692 . . . . 0.0 112.13 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -154.85 -178.72 7.42 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -178.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.8 t -134.06 -177.76 4.72 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.307 1.043 . . . . 0.0 109.77 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 99.76 9.82 48.44 Favored Glycine 0 CA--C 1.527 0.826 0 CA-C-O 119.746 -0.474 . . . . 0.0 111.97 -177.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -125.67 -26.07 3.58 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 117.659 0.729 . . . . 0.0 112.5 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.3 t -164.52 155.09 14.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.812 0.445 . . . . 0.0 110.587 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -103.43 -8.05 20.48 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.038 0.535 . . . . 0.0 110.532 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -78.47 -38.42 41.06 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 122.723 0.409 . . . . 0.0 112.055 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 58.4 m -156.06 167.7 29.57 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 111.399 -171.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -83.8 167.52 17.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.644 0.778 . . . . 0.0 110.825 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -151.52 160.21 43.79 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 124.322 1.049 . . . . 0.0 108.616 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.05 -168.46 41.6 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.833 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.02 160.27 22.32 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.507 0.723 . . . . 0.0 110.827 -179.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.4 mt -138.06 161.76 35.92 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.268 1.427 . . . . 0.0 107.921 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -151.64 147.41 26.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.244 -0.285 . . . . 0.0 110.873 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -125.03 173.54 8.62 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.722 1.209 . . . . 0.0 112.723 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -74.68 -7.55 53.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.8 t -158.98 158.26 32.89 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 122.484 0.314 . . . . 0.0 111.119 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -68.05 -27.91 66.93 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.501 0.32 . . . . 0.0 110.532 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 85.3 p -77.08 -23.77 51.89 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.273 0.229 . . . . 0.0 110.839 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -76.82 -35.51 57.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.248 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.19 -28.49 61.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 122.187 -0.321 . . . . 0.0 110.353 174.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.4 tp -73.09 -42.98 62.42 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.061 0.544 . . . . 0.0 111.17 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -70.2 -35.3 73.83 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -178.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.82 -21.85 63.35 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.57 -39.19 88.36 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.07 -26.94 73.63 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.761 -0.466 . . . . 0.0 112.309 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.347 10.6 m-85 -102.16 -1.23 31.83 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 119.437 3.125 . . . . 0.0 119.437 179.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 60.4 mt -135.79 -4.59 2.23 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.828 1.195 . . . . 0.0 114.137 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.92 143.89 47.54 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 119.962 1.255 . . . . 0.0 109.094 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.87 15.41 3.85 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.369 1.068 . . . . 0.0 113.341 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -70.06 139.04 52.55 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -73.93 136.9 43.33 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.822 -0.549 . . . . 0.0 111.942 -175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.4 mtm -83.57 152.56 24.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.894 0.478 . . . . 0.0 110.676 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.8 pttp . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.083 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.66 165.26 30.66 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.933 3.089 . . . . 0.0 111.414 177.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.91 142.35 50.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 102.825 -3.028 . . . . 0.0 102.825 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.7 143.53 42.07 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.4 tt -89.05 152.22 21.8 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.601 1.16 . . . . 0.0 108.95 173.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.95 150.75 44.9 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.023 -0.423 . . . . 0.0 110.777 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.27 162.05 40.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 22.3 p -165.49 168.27 16.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -54.94 129.58 38.21 Favored 'General case' 0 N--CA 1.457 -0.09 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.7 t -81.16 148.57 29.51 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -114.04 8.21 17.0 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 169.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.98 158.91 21.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.068 0.947 . . . . 0.0 111.744 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -91.84 -3.41 56.1 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.489 -178.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -154.53 172.77 17.27 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.553 0.741 . . . . 0.0 110.541 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.97 23.36 1.37 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.972 0.909 . . . . 0.0 109.802 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.253 1.255 0 CA-C-O 117.427 -1.273 . . . . 0.0 110.515 -176.416 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo . . . . . 0 N--CA 1.456 -0.731 0 N-CA-C 110.942 -0.445 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -142.99 157.24 44.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.89 0.476 . . . . 0.0 110.765 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.97 158.93 34.5 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.514 0.725 . . . . 0.0 110.948 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -73.74 -4.39 34.27 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -158.08 147.91 15.33 Favored Pre-proline 0 N--CA 1.456 -0.131 0 C-N-CA 123.177 0.591 . . . . 0.0 110.035 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.27 -15.22 47.47 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.908 2.406 . . . . 0.0 110.322 174.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.5 t -91.26 154.79 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.583 0.753 . . . . 0.0 112.752 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.8 tt -140.41 152.07 45.42 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 125.152 1.381 . . . . 0.0 108.297 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -134.8 134.34 40.76 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.452 0.301 . . . . 0.0 111.033 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -129.91 152.71 37.78 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.069 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -142.96 173.75 11.28 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 86.62 11.29 71.56 Favored Glycine 0 CA--C 1.527 0.808 0 O-C-N 122.242 -0.286 . . . . 0.0 112.48 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 41.2 mt -76.3 39.68 0.2 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.739 0.816 . . . . 0.0 110.998 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -74.34 18.67 0.15 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -136.98 156.27 48.65 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.943 0.497 . . . . 0.0 111.439 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 36.6 t -69.19 -15.38 63.38 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.52 0.728 . . . . 0.0 111.883 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -74.28 5.01 4.91 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 91.0 mmm -114.18 141.37 47.6 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.301 0.501 . . . . 0.0 110.782 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -162.36 168.02 22.83 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.568 1.147 . . . . 0.0 108.963 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 95.1 m -54.83 -32.11 60.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.902 0.481 . . . . 0.0 111.981 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.36 -38.6 60.0 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -66.39 -48.3 70.55 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -177.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.23 -49.41 84.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.422 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.268 1.4 m-85 -61.14 -56.87 15.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 178.025 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -57.44 -33.81 68.31 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.792 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.21 -64.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.572 0.5 OUTLIER -76.56 -5.52 48.01 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 176.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 50.5 t -74.77 -32.24 62.0 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.5 pp -63.3 -17.6 62.71 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.629 172.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -91.73 -8.83 45.8 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.73 -179.26 41.7 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 118.375 0.534 . . . . 0.0 112.455 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -80.67 129.99 34.84 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 122.599 -0.353 . . . . 0.0 110.958 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 0.8 OUTLIER -114.05 165.55 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.451 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -129.29 -63.34 0.95 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -154.42 158.81 40.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.295 0.952 . . . . 0.0 113.157 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . 0.41 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.5 p -138.52 150.94 24.09 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 C-N-CA 123.908 0.883 . . . . 0.0 110.267 -175.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -150.78 122.14 7.86 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.964 0.906 . . . . 0.0 110.417 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.259 6.6 m-85 -80.51 155.43 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 177.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 mmt -100.26 115.96 31.13 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.783 0.433 . . . . 0.0 110.949 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -79.15 -14.26 59.21 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.69 0.396 . . . . 0.0 111.341 172.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.7 p -85.0 -5.48 59.35 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.322 0.649 . . . . 0.0 112.251 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -126.21 156.73 71.83 Favored Pre-proline 0 CA--C 1.529 0.153 0 C-N-CA 123.554 0.741 . . . . 0.0 109.903 -177.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.63 -15.06 40.77 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.189 2.593 . . . . 0.0 111.592 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.19 92.07 0.08 OUTLIER Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.99 159.72 41.75 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.38 166.7 32.65 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.276 0.56 . . . . 0.0 110.578 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 41.1 ttp -129.49 147.43 51.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.275 1.03 . . . . 0.0 109.065 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.67 157.05 20.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -137.17 133.83 35.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 26.3 mtm -153.02 177.96 10.22 Favored 'General case' 0 C--O 1.23 0.078 0 C-N-CA 123.934 0.894 . . . . 0.0 109.957 -173.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.09 118.64 10.13 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 171.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -72.3 -33.3 67.3 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -168.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.69 -86.21 0.02 OUTLIER Glycine 0 C--N 1.335 0.524 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -177.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -74.5 -28.53 61.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.81 -34.06 18.4 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.984 -174.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.4 t -88.76 -23.99 6.17 Favored 'Isoleucine or valine' 0 C--N 1.341 0.225 0 C-N-CA 118.828 -1.149 . . . . 0.0 109.47 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.83 -52.06 33.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.943 174.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -68.17 -32.7 73.13 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 121.874 -0.516 . . . . 0.0 112.386 -176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.67 -34.19 75.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 118.721 0.691 . . . . 0.0 110.584 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.53 -12.69 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.31 0.644 . . . . 0.0 110.731 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.7 m -92.42 -21.24 20.31 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -128.6 -28.17 2.53 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.72 -15.16 7.99 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 120.486 1.494 . . . . 0.0 114.447 -172.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.646 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.63 100.82 2.38 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 116.83 2.159 . . . . 0.0 116.83 -167.59 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.624 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 12.1 m-80 76.84 21.95 1.14 Allowed 'General case' 0 N--CA 1.482 1.144 0 O-C-N 117.743 -3.098 . . . . 0.0 113.199 -161.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -81.03 163.13 23.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.873 -1.142 . . . . 0.0 108.769 167.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -82.62 140.94 32.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.9 ttt -159.7 138.7 10.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.09 0.556 . . . . 0.0 110.15 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.419 46.4 m-85 57.03 20.71 5.64 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.91 70.67 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -134.19 -167.58 1.98 Allowed 'General case' 0 C--O 1.231 0.092 0 C-N-CA 124.326 1.05 . . . . 0.0 108.866 177.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -129.71 143.08 50.65 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.8 ptm -118.02 84.59 2.2 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.991 0.517 . . . . 0.0 110.393 -177.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 2.7 m-20 -54.44 128.4 31.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.779 -173.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.646 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.441 2.3 t -126.19 154.38 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 113.286 -3.366 . . . . 0.0 115.848 168.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 45.8 t -162.99 166.79 23.34 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.477 1.511 . . . . 0.0 108.716 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 10.2 t -68.61 145.16 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 O-C-N 121.855 -0.528 . . . . 0.0 112.084 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.4 t -84.41 155.99 22.01 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.635 0.374 . . . . 0.0 111.144 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -96.54 -9.62 29.1 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.51 -0.119 . . . . 0.0 110.711 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -76.31 148.51 80.77 Favored Pre-proline 0 N--CA 1.454 -0.264 0 C-N-CA 123.404 0.682 . . . . 0.0 110.658 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.22 -32.87 3.79 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.364 2.71 . . . . 0.0 111.617 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.81 157.89 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.286 0.634 . . . . 0.0 110.671 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 17.7 mt -82.58 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 49.7 mmm -93.9 119.78 66.54 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 122.476 0.31 . . . . 0.0 110.382 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.49 154.47 45.13 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.213 2.609 . . . . 0.0 109.337 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 154.53 -113.06 0.55 Allowed Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.38 163.49 27.91 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.499 0.666 . . . . 0.0 111.905 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 14.7 t -157.37 160.12 38.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.44 1.096 . . . . 0.0 109.632 -177.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -130.07 0.73 4.72 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.39 175.07 44.76 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 93.8 mt -143.41 157.03 44.79 Favored 'General case' 0 N--CA 1.458 -0.074 0 C-N-CA 124.235 1.014 . . . . 0.0 109.179 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -75.6 -8.04 55.77 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . 0.253 11.9 t0 -120.49 26.89 8.89 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 122.039 0.923 . . . . 0.0 112.665 175.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.51 -150.83 7.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 69.4 m -133.05 -16.9 2.45 Favored 'General case' 0 N--CA 1.458 -0.07 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.9 m -127.04 149.14 50.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.863 0.465 . . . . 0.0 111.368 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.9 p -89.77 7.19 38.15 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 110.137 173.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -139.77 148.64 42.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.993 1.317 . . . . 0.0 113.275 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -154.7 158.2 39.23 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.05 0.387 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -127.7 136.65 51.86 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -134.07 4.66 3.52 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -179.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -64.85 -22.01 66.91 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.127 0.571 . . . . 0.0 112.046 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -114.02 1.21 14.59 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.05 0.54 . . . . 0.0 111.777 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.9 m -75.73 149.81 37.96 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.023 0.44 . . . . 0.0 111.53 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -80.12 -11.14 59.78 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.157 0.583 . . . . 0.0 111.151 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -62.05 -23.93 66.78 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.155 0.582 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -60.89 128.68 37.68 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.832 0.453 . . . . 0.0 110.27 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -73.18 -33.64 65.54 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.349 61.0 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -63.87 -21.95 66.69 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -173.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -135.19 150.5 72.95 Favored Pre-proline 0 C--O 1.23 0.071 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.6 -25.45 24.69 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.24 2.627 . . . . 0.0 111.412 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -80.03 -22.55 42.26 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.01 -0.431 . . . . 0.0 110.509 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -82.21 -41.65 20.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 172.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.26 -20.08 63.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.653 0.381 . . . . 0.0 111.858 -178.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.65 -19.71 48.45 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.472 0.309 . . . . 0.0 111.759 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -123.97 2.25 8.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -61.44 156.34 19.5 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.482 0.583 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -140.03 137.13 34.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -175.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.3 mm -141.12 144.02 27.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 123.595 0.758 . . . . 0.0 109.119 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -147.93 167.87 23.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.554 0.741 . . . . 0.0 111.086 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -63.0 155.36 73.07 Favored Pre-proline 0 N--CA 1.455 -0.196 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 172.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -66.01 135.49 41.0 Favored 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.191 1.927 . . . . 0.0 108.456 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -154.12 173.71 15.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.77 0.428 . . . . 0.0 110.076 -172.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -83.79 -8.77 59.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.7 -0.19 . . . . 0.0 111.161 -178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.64 138.04 20.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.2 tp -139.18 151.22 46.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -123.02 149.37 44.44 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.771 0.828 . . . . 0.0 108.906 -178.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -143.99 159.13 43.13 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -152.55 167.76 27.77 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.363 -2.458 . . . . 0.0 104.363 -176.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 60.61 57.53 2.71 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.174 0.59 . . . . 0.0 112.231 -173.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -136.08 122.46 14.02 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-O 119.442 -0.314 . . . . 0.0 111.186 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.67 164.1 1.06 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.944 3.096 . . . . 0.0 113.279 172.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.42 -17.3 64.18 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.887 0.875 . . . . 0.0 112.062 -175.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -97.93 3.98 49.55 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 47.0 t -73.07 -18.17 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.3 m -55.38 -177.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 117.638 -1.172 . . . . 0.0 113.813 -165.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -18.84 -44.53 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.254 1.822 . . . . 0.0 114.834 -169.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.0 mt-10 -57.06 -48.23 79.05 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 173.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -87.64 -28.36 21.9 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 121.968 2.167 . . . . 0.0 106.323 -173.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -61.88 -35.81 79.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -75.84 -42.72 48.83 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.07 -22.3 42.42 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.477 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.6 mt -75.58 -45.01 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.126 0 CA-C-N 118.417 0.553 . . . . 0.0 110.648 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 30.7 p -68.32 -32.11 72.01 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.045 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -64.77 -39.28 93.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.834 0.349 . . . . 0.0 111.924 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.5 tp10 -71.39 -28.58 64.13 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.584 0.353 . . . . 0.0 111.272 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.75 -4.74 59.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.233 0.613 . . . . 0.0 111.691 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.6 27.85 56.31 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.829 -0.429 . . . . 0.0 112.219 175.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 6.0 p -129.73 152.58 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 C-N-CA 123.263 0.625 . . . . 0.0 112.027 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -68.64 152.93 44.69 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 121.203 0.525 . . . . 0.0 111.802 -175.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -82.24 156.23 69.14 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.81 0.844 . . . . 0.0 110.607 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.24 153.21 77.93 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.261 2.641 . . . . 0.0 111.108 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -84.78 -15.49 44.78 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.8 t -153.5 160.85 42.63 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.37 149.37 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 C-N-CA 123.311 0.645 . . . . 0.0 109.491 -176.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -147.07 143.91 28.68 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.103 0.961 . . . . 0.0 108.816 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 4.7 t -138.83 143.2 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.058 0 C-N-CA 122.877 0.471 . . . . 0.0 111.998 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -152.89 -175.23 5.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.8 p -146.12 -171.5 3.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.886 0.874 . . . . 0.0 110.28 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 102.2 -10.18 56.59 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 123.97 0.795 . . . . 0.0 111.908 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -89.87 -27.22 20.05 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 117.597 0.699 . . . . 0.0 111.648 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 83.5 p -165.83 163.86 18.72 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.447 0.699 . . . . 0.0 109.581 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -97.04 -4.21 40.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.716 0.406 . . . . 0.0 110.914 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.63 -40.6 48.77 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 89.2 p -163.21 170.6 17.5 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.14 0.495 . . . . 0.0 111.052 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.0 p -83.27 174.2 10.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.33 0.652 . . . . 0.0 110.186 177.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.9 p -153.74 162.41 41.26 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.35 -170.5 43.34 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.057 -177.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.08 160.39 22.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.484 0.713 . . . . 0.0 110.288 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -138.66 161.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.932 1.293 . . . . 0.0 108.367 177.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.75 148.73 28.9 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.28 -0.262 . . . . 0.0 111.099 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 21.3 m-90 -127.87 173.19 10.2 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.715 1.206 . . . . 0.0 112.343 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -75.19 -10.36 59.4 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.617 0.367 . . . . 0.0 110.459 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -157.93 160.73 37.9 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 121.735 -0.603 . . . . 0.0 111.118 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -74.1 -22.34 59.52 Favored 'General case' 0 CA--C 1.527 0.089 0 O-C-N 122.386 -0.196 . . . . 0.0 110.942 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 88.3 p -77.78 -27.29 50.19 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -71.51 -35.93 70.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.4 56.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.0 tp -78.23 -41.73 33.37 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.398 0.279 . . . . 0.0 111.409 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -68.59 -39.04 81.09 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.2 m -67.7 -28.42 67.66 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.4 tt -71.22 -36.88 72.02 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.19 -32.04 75.14 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 119.632 -0.538 . . . . 0.0 111.831 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.326 9.8 m-85 -100.69 -14.5 18.07 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 119.114 3.005 . . . . 0.0 119.114 177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.69 -14.53 14.79 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.972 0.806 . . . . 0.0 112.031 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -70.09 140.93 52.81 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.397 0.999 . . . . 0.0 109.073 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.47 20.29 3.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.673 1.189 . . . . 0.0 112.856 -178.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.35 135.57 52.02 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -75.98 130.93 39.18 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.121 -0.362 . . . . 0.0 111.492 -176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 61.6 mtm -100.95 152.67 20.28 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 123.145 0.578 . . . . 0.0 111.421 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 C--O 1.232 0.179 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 169.993 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.4 p90 . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -79.58 167.67 20.6 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 123.757 2.971 . . . . 0.0 111.946 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -128.83 142.35 51.0 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 170.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.281 0.6 OUTLIER -85.99 137.95 32.34 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -175.805 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.0 134.99 37.72 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.75 149.52 50.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 118.483 0.583 . . . . 0.0 110.574 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.53 162.49 39.93 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.864 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 21.9 p -163.73 170.82 16.45 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.398 0.679 . . . . 0.0 110.909 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -56.12 125.09 20.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 37.2 t -80.81 151.97 28.48 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.2 t -114.64 7.09 15.91 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.41 1.084 . . . . 0.0 113.767 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.83 163.95 20.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.148 0.979 . . . . 0.0 111.96 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -97.69 -2.84 40.48 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.608 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -154.55 170.27 21.87 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.518 0.727 . . . . 0.0 110.17 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.88 23.55 1.38 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.193 0.597 . . . . 0.0 110.45 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 117.627 -1.177 . . . . 0.0 110.74 -176.401 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo . . . . . 0 N--CA 1.453 -0.886 0 N-CA-C 110.848 -0.481 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -146.57 159.8 42.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.311 0.645 . . . . 0.0 110.352 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.73 157.41 38.08 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.585 0.354 . . . . 0.0 111.234 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -79.62 -3.03 45.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.111 0.564 . . . . 0.0 110.544 -177.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 47.1 t -155.97 151.13 21.1 Favored Pre-proline 0 CA--C 1.532 0.267 0 O-C-N 121.498 -0.751 . . . . 0.0 111.341 -177.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.29 -4.3 3.95 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.473 3.449 . . . . 0.0 114.03 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 451' ' ' SER . 6.5 m -128.47 165.77 27.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.95 0.881 . . . . 0.0 109.892 -174.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.65 159.57 41.96 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.937 1.695 . . . . 0.0 107.733 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.6 ttt -143.59 138.89 29.38 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.538 0.608 . . . . 0.0 111.145 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -121.19 154.44 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -175.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.44 171.09 14.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.1 13.13 72.23 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 122.141 -0.35 . . . . 0.0 112.302 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.28 28.34 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.747 0.819 . . . . 0.0 111.581 178.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -64.6 -26.33 68.36 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.424 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -76.84 149.44 36.17 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.064 0.459 . . . . 0.0 110.996 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.8 p -70.58 -6.73 38.73 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.615 0.766 . . . . 0.0 112.646 -176.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -77.95 -14.34 59.57 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.954 0.501 . . . . 0.0 112.021 -176.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 80.3 mmm -86.05 154.29 21.52 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.034 0.379 . . . . 0.0 111.23 -178.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -164.0 164.34 23.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.315 1.046 . . . . 0.0 108.509 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.0 p -64.03 -29.77 70.89 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.034 -0.416 . . . . 0.0 111.978 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.02 -26.86 36.09 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -70.96 -50.79 30.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.435 0.636 . . . . 0.0 109.606 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.15 -47.47 92.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.264 1.3 m-85 -63.25 -52.35 62.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 178.06 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -59.42 -33.86 71.77 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 120.16 1.346 . . . . 0.0 109.458 -172.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 15.0 t -62.48 -61.88 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.561 0.8 OUTLIER -76.51 -4.98 45.57 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 176.216 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 52.9 t -75.26 -32.57 61.11 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.6 pp -62.41 -19.55 63.56 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.561 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.43 -9.31 52.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 116.919 2.192 . . . . 0.0 116.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 159.12 178.29 32.99 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 118.298 0.499 . . . . 0.0 112.234 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -68.51 140.21 55.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.435 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 18.2 m -114.01 165.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.918 1.287 . . . . 0.0 109.339 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -137.47 -60.71 0.66 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.81 154.7 37.78 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 118.738 0.699 . . . . 0.0 112.855 -175.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.9 146.72 19.73 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 C-N-CA 123.181 0.592 . . . . 0.0 109.976 176.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.2 133.07 13.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.632 0.373 . . . . 0.0 110.555 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.271 11.8 m-85 -80.38 149.6 30.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.7 mmt -75.01 131.95 40.99 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.135 0.493 . . . . 0.0 111.553 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -79.24 -25.5 42.59 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.879 0.871 . . . . 0.0 111.827 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 94.8 p -101.94 -6.78 23.06 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -113.89 152.74 45.92 Favored Pre-proline 0 CA--C 1.529 0.171 0 CA-C-N 118.507 0.594 . . . . 0.0 110.193 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.34 -15.9 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.463 2.776 . . . . 0.0 112.168 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 179.84 91.3 0.08 OUTLIER Glycine 0 C--N 1.337 0.611 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.84 159.91 35.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.639 0.775 . . . . 0.0 109.308 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.11 142.04 18.07 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.747 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.6 ptm -91.39 150.43 21.28 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.4 t -138.86 151.28 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.558 0.743 . . . . 0.0 112.13 -173.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -131.89 132.82 43.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 84.9 mtp -155.2 172.91 17.38 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.463 0.705 . . . . 0.0 109.691 -171.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.88 112.07 3.59 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.264 -2.125 . . . . 0.0 105.264 169.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -72.46 -33.41 67.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -166.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.74 -87.42 0.01 OUTLIER Glycine 0 CA--C 1.52 0.351 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -74.52 -27.3 60.48 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.11 -34.39 17.92 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.798 -174.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 96.6 t -85.92 -25.85 6.47 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 118.525 -1.27 . . . . 0.0 108.576 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -63.89 -52.63 59.06 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.316 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -68.91 -31.89 71.13 Favored 'General case' 0 N--CA 1.457 -0.088 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.95 -34.58 78.43 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.559 0.618 . . . . 0.0 110.219 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 41.5 mt -77.92 -13.98 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.463 0.705 . . . . 0.0 110.926 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.9 m -91.97 -22.03 20.22 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.46 -20.24 3.32 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -169.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 63.9 mt -134.48 -14.56 2.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.02 2.44 Favored 'General case' 0 C--O 1.198 -1.622 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 -169.368 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.596 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.3 m-80 76.87 22.06 1.12 Allowed 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.012 -2.93 . . . . 0.0 112.491 -161.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -85.79 162.93 18.45 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -78.72 141.94 37.48 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.8 ttt -162.03 137.85 7.61 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.262 0.625 . . . . 0.0 109.912 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.411 49.4 m-85 56.76 28.87 14.98 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.96 9.26 86.79 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -134.0 -167.67 1.99 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.036 1.334 . . . . 0.0 108.7 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -138.17 143.91 40.49 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.36 105.3 8.98 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.596 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 23.5 m-20 -64.08 132.02 49.25 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 115.709 -2.091 . . . . 0.0 111.729 -173.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.1 t -125.75 151.8 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 113.229 -3.388 . . . . 0.0 115.567 169.258 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -163.99 170.03 17.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.472 1.109 . . . . 0.0 108.568 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 5.5 t -69.85 144.31 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . 0.449 ' HB3' HG23 ' A' ' 380' ' ' VAL . 15.9 t -87.66 153.88 21.03 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.057 0.543 . . . . 0.0 110.822 177.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -101.89 1.37 36.83 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -73.87 156.21 88.26 Favored Pre-proline 0 N--CA 1.454 -0.233 0 C-N-CA 123.272 0.629 . . . . 0.0 110.036 176.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -75.87 -42.69 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.667 2.245 . . . . 0.0 111.019 176.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -171.04 164.7 7.51 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 124.196 0.998 . . . . 0.0 109.457 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.09 137.72 21.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 7.8 mmm -107.33 132.6 20.84 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 122.542 0.337 . . . . 0.0 110.691 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.1 158.61 45.39 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.228 2.619 . . . . 0.0 109.105 173.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.82 -133.1 3.59 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.368 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -72.55 158.79 35.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.599 0.76 . . . . 0.0 110.75 -176.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -151.2 169.45 21.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.433 0.693 . . . . 0.0 109.766 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -122.65 1.68 9.47 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.51 -175.14 54.95 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.35 162.39 36.57 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 124.387 1.075 . . . . 0.0 109.165 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 11.0 pm0 -70.08 -22.01 63.09 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -120.49 13.41 11.76 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -159.04 167.13 34.8 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 121.986 -0.446 . . . . 0.0 112.17 -176.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 t -86.35 -29.79 22.7 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.782 0.433 . . . . 0.0 111.777 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 87.4 m -127.06 151.52 48.5 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.008 0.523 . . . . 0.0 111.639 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 84.4 p -82.24 7.27 14.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.262 0.625 . . . . 0.0 110.728 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -134.04 147.5 50.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.312 1.445 . . . . 0.0 114.824 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -152.63 153.45 33.36 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.883 0.473 . . . . 0.0 110.315 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.256 0.1 OUTLIER -133.98 145.73 49.78 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -127.33 10.78 6.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 34.6 t -65.33 -22.59 66.84 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.259 0.624 . . . . 0.0 111.91 -174.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -114.05 2.04 14.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.045 0.538 . . . . 0.0 111.637 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -77.32 146.51 36.71 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.766 0.317 . . . . 0.0 111.372 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -79.25 -8.21 58.86 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.393 0.277 . . . . 0.0 110.87 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -63.08 -21.66 66.33 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -59.04 123.35 16.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.566 0.346 . . . . 0.0 110.125 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -80.97 -32.6 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -176.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.285 55.1 m-85 -97.96 14.26 27.94 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.4 p -74.61 -6.67 49.89 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.28 149.83 69.05 Favored Pre-proline 0 C--O 1.23 0.059 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -71.4 -24.72 22.34 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 123.235 2.623 . . . . 0.0 111.301 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -81.37 -23.97 37.35 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.066 0.394 . . . . 0.0 110.751 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -82.84 -41.81 18.59 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 173.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.21 -18.18 64.27 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.462 0.305 . . . . 0.0 111.579 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.11 -18.9 52.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.757 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -2.54 8.14 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.54 152.6 41.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.872 0.76 . . . . 0.0 110.772 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -150.91 138.61 19.75 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.9 mt -139.78 145.66 26.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 123.829 0.851 . . . . 0.0 108.909 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -145.3 173.48 11.93 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.6 0.76 . . . . 0.0 110.523 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -56.99 154.3 19.79 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.088 0.555 . . . . 0.0 109.558 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -63.5 148.75 92.34 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.701 2.267 . . . . 0.0 110.097 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.1 t -152.57 167.39 29.01 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.804 -174.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.66 -0.69 51.73 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 122.315 -0.241 . . . . 0.0 111.051 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 3.0 t -97.57 134.53 35.28 Favored 'Isoleucine or valine' 0 C--O 1.231 0.084 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -117.51 157.76 25.73 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.865 0.866 . . . . 0.0 109.136 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -129.37 136.97 50.67 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.166 0.986 . . . . 0.0 108.37 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -125.82 158.07 35.94 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -177.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -147.63 165.52 30.16 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 103.656 -2.72 . . . . 0.0 103.656 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.5 m120 57.95 57.42 4.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.882 0.473 . . . . 0.0 111.864 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -126.55 152.56 74.63 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.345 0.658 . . . . 0.0 110.322 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.413 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 74.0 Cg_endo -68.72 162.59 40.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.728 2.286 . . . . 0.0 110.658 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.46 -16.56 63.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.202 0.601 . . . . 0.0 111.317 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -112.54 22.26 14.79 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.329 0.651 . . . . 0.0 111.388 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.3 p -65.93 -15.12 18.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -176.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.88 -177.23 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 117.793 -1.098 . . . . 0.0 113.863 -165.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.615 ' H ' HG22 ' A' ' 510' ' ' THR . 23.5 pt-20 -27.32 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -169.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.9 mt-10 -57.57 -47.86 80.93 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 117.545 -1.217 . . . . 0.0 114.244 170.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -86.0 -27.67 24.68 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-N 122.287 2.312 . . . . 0.0 106.346 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.52 -33.53 75.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 176.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -77.52 -41.19 40.1 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.13 -28.45 57.44 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.015 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 69.9 mt -73.32 -40.22 56.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.115 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.42 -30.17 70.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.83 -43.7 71.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -68.86 -22.08 64.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 O-C-N 122.17 -0.331 . . . . 0.0 111.837 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.88 -5.23 48.44 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.923 0.489 . . . . 0.0 111.321 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.08 4.73 60.18 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-O 119.655 -0.525 . . . . 0.0 113.782 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.02 162.44 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 CA-C-N 118.154 0.977 . . . . 0.0 112.98 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -73.34 143.86 46.74 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 174.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -71.92 149.3 92.47 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 122.823 0.449 . . . . 0.0 111.193 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.38 155.9 62.88 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.622 2.881 . . . . 0.0 110.733 177.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -86.0 -17.95 33.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.4 t -154.8 156.79 36.89 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.515 0.198 . . . . 0.0 110.995 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 96.5 t -145.06 145.6 20.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 123.879 0.872 . . . . 0.0 110.199 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -146.92 145.9 29.95 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 123.252 0.621 . . . . 0.0 109.833 175.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 7.9 t -143.7 144.55 23.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -177.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -153.78 -175.43 5.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 91.8 p -133.59 -178.99 5.25 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.543 0.737 . . . . 0.0 110.756 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 97.43 -7.22 63.69 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.862 0.744 . . . . 0.0 112.375 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -86.69 -34.84 19.6 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.715 0.757 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 39.7 t -167.18 158.39 12.0 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.963 0.505 . . . . 0.0 110.265 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -96.89 -7.97 32.03 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.2 -28.85 19.7 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.433 0.693 . . . . 0.0 111.549 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.9 p -160.56 155.91 24.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.245 0.545 . . . . 0.0 112.044 -178.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.5 t -84.22 171.98 12.29 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 66.7 m -146.75 163.64 35.32 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.631 1.172 . . . . 0.0 109.455 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.98 -173.11 46.05 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.61 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -122.39 160.39 25.55 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.597 0.759 . . . . 0.0 110.828 -177.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 70.4 mt -139.54 158.94 43.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.835 1.254 . . . . 0.0 108.48 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -150.76 147.5 27.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.936 0.335 . . . . 0.0 111.569 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -122.81 169.27 11.28 Favored 'General case' 0 C--N 1.338 0.073 0 C-N-CA 124.867 1.267 . . . . 0.0 112.633 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -76.42 -8.24 56.72 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.887 0.475 . . . . 0.0 110.861 -176.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.9 t -156.26 158.44 37.52 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 121.708 -0.62 . . . . 0.0 111.165 -178.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.01 -30.01 67.22 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.384 0.273 . . . . 0.0 111.192 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 71.8 m -79.34 -26.33 42.14 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 110.483 -0.192 . . . . 0.0 110.483 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -72.52 -30.98 64.97 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 121.042 0.449 . . . . 0.0 111.355 174.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.92 -28.04 55.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.864 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 51.6 tp -79.93 -35.2 38.11 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.439 0.296 . . . . 0.0 111.455 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -74.41 -38.35 63.1 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.725 -0.609 . . . . 0.0 109.414 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.263 0.3 OUTLIER -72.45 -21.41 61.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 175.38 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.64 -36.05 78.08 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 170.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.42 -43.96 95.99 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.253 6.6 m-85 -85.64 -18.63 32.69 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -106.56 -12.76 15.51 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.935 0.789 . . . . 0.0 112.396 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -74.98 141.05 44.03 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.239 0.927 . . . . 0.0 109.269 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 55.07 19.24 2.67 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.294 1.037 . . . . 0.0 112.636 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.253 39.9 t80 -73.24 139.2 46.05 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -72.5 125.42 27.39 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 122.309 0.243 . . . . 0.0 110.868 -176.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . 0.413 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 75.3 mtm -83.52 152.69 24.78 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.686 0.395 . . . . 0.0 111.926 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.424 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 N--CA 1.455 -0.191 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.0 160.12 43.53 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.948 3.099 . . . . 0.0 111.717 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -129.92 142.39 50.66 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 102.677 -3.083 . . . . 0.0 102.677 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.258 0.7 OUTLIER -77.37 138.37 39.27 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 179.078 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.3 tt -83.14 151.85 25.54 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.42 150.42 47.63 Favored 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.546 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -157.25 165.15 36.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 111.184 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 28.8 p -158.99 170.37 22.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.45 0.7 . . . . 0.0 109.713 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -56.48 125.71 23.26 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 177.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.1 t -86.64 152.42 22.59 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -169.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -111.7 10.13 20.98 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.34 14.18 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 124.046 0.938 . . . . 0.0 111.836 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.8 mm-40 -92.01 -3.92 55.19 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.98 178.36 3.44 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.636 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.76 32.01 1.43 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.349 0.26 . . . . 0.0 111.63 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.43 -1.271 . . . . 0.0 110.701 -178.959 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 N--CA 1.454 -0.837 0 N-CA-C 109.825 -0.875 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . 0.401 ' HA ' ' HA2' ' A' ' 426' ' ' GLY . 41.1 p-80 -154.63 157.91 38.9 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.321 0.581 . . . . 0.0 112.182 -178.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.64 166.24 23.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.95 0.9 . . . . 0.0 111.391 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.22 -8.28 53.89 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -159.49 147.35 13.28 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 122.725 0.41 . . . . 0.0 110.985 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -13.75 36.16 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 123.565 2.843 . . . . 0.0 110.965 173.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -86.22 146.43 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -134.88 155.04 51.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.5 1.12 . . . . 0.0 108.488 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.31 134.83 34.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -174.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.07 150.46 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.097 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -139.96 176.31 8.85 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 105.254 -2.128 . . . . 0.0 105.254 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 81.74 11.84 82.31 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 116.417 -0.356 . . . . 0.0 112.426 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 62.7 mt -79.29 22.76 0.41 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.652 0.726 . . . . 0.0 112.131 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -65.17 -25.64 67.82 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -175.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.439 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.1 pm0 -66.92 157.06 34.19 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.395 0.617 . . . . 0.0 111.599 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 81.6 p -79.05 27.39 0.24 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.75 1.22 . . . . 0.0 112.23 -172.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.87 4.23 4.15 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.294 0.638 . . . . 0.0 112.696 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 39.9 mmm -102.37 141.89 34.46 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.729 0.3 . . . . 0.0 110.201 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -154.27 152.64 30.53 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.211 0.604 . . . . 0.0 109.47 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -57.68 -37.07 72.83 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -71.3 -38.47 71.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.247 0.476 . . . . 0.0 112.184 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -76.02 -45.58 33.76 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.147 0.579 . . . . 0.0 112.233 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.61 -42.36 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -75.91 -29.93 58.59 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.764 -170.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . 0.4 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 2.0 p30 -76.97 -30.88 56.18 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.893 1.224 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.54 -55.75 19.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 N-CA-C 106.405 -1.702 . . . . 0.0 106.405 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.541 5.4 p90 -76.6 -4.91 45.41 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 173.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 49.9 t -74.63 -30.52 61.68 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.924 -0.485 . . . . 0.0 110.624 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.0 pp -62.34 -16.3 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.301 -0.559 . . . . 0.0 111.152 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -87.53 -7.33 57.7 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.55 -172.28 44.84 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.226 -178.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -85.03 121.04 27.23 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.082 0.553 . . . . 0.0 109.816 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.5 9.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -130.16 -59.92 1.03 Allowed 'General case' 0 C--N 1.339 0.144 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -144.14 169.77 17.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.859 1.208 . . . . 0.0 112.51 -177.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.0 p -147.24 144.13 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 125.057 1.343 . . . . 0.0 108.24 175.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -154.39 124.16 6.67 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 117.961 0.346 . . . . 0.0 111.438 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.263 5.9 m-85 -72.68 155.24 40.2 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 35.9 mmt -84.92 128.73 34.75 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.271 0.629 . . . . 0.0 111.64 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -18.29 53.29 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 84.1 p -101.95 1.59 36.91 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -126.89 152.03 74.74 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 118.342 0.519 . . . . 0.0 110.623 -175.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.0 -15.6 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.535 2.823 . . . . 0.0 111.441 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.63 94.96 0.1 OUTLIER Glycine 0 C--N 1.338 0.66 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.54 160.0 31.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.651 0.78 . . . . 0.0 109.208 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.15 144.67 14.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 77.6 mtp -84.7 154.2 22.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.712 0.805 . . . . 0.0 109.335 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 38.1 t -147.48 152.12 13.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -134.21 139.88 46.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.114 -0.366 . . . . 0.0 110.06 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.4 ptp -164.14 172.49 13.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.273 1.029 . . . . 0.0 110.047 -174.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.33 126.77 28.55 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.91 -34.03 66.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -169.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 375' ' ' HIS . . . -58.68 -85.79 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -178.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -64.15 -37.42 87.41 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.46 -35.96 17.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.401 -0.809 . . . . 0.0 112.876 -171.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.2 t -83.18 -28.29 7.87 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 CA-C-N 120.242 1.383 . . . . 0.0 109.153 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -68.71 -47.29 66.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.753 177.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -68.12 -36.87 80.43 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -176.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.69 77.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.944 0.793 . . . . 0.0 109.814 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 46.9 mt -76.48 -14.81 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 122.826 0.45 . . . . 0.0 110.85 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 55.4 m -97.24 -17.42 19.84 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -130.27 -26.13 2.37 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 116.29 1.959 . . . . 0.0 116.29 -169.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.61 -11.09 2.4 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 120.532 1.515 . . . . 0.0 114.27 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.633 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.96 101.18 2.62 Favored 'General case' 0 C--O 1.198 -1.615 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 -168.091 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 7.4 m-80 77.19 21.47 1.08 Allowed 'General case' 0 N--CA 1.483 1.221 0 O-C-N 117.381 -3.325 . . . . 0.0 112.763 -163.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.21 159.67 28.4 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.536 -0.728 . . . . 0.0 110.002 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -74.33 136.79 42.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 115.675 1.731 . . . . 0.0 115.675 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -157.96 140.9 14.94 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.351 0.661 . . . . 0.0 109.531 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 59.44 17.5 6.03 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.73 10.22 85.42 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -174.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -132.39 -162.26 1.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.509 1.523 . . . . 0.0 108.31 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -135.36 146.97 48.91 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 122.646 0.378 . . . . 0.0 110.812 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.63 99.93 5.34 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 176.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -65.22 131.33 46.22 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 115.746 -2.073 . . . . 0.0 112.487 -171.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.633 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.449 2.1 t -125.91 152.13 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 112.62 -3.632 . . . . 0.0 115.809 168.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.8 t -162.96 171.26 16.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.778 1.231 . . . . 0.0 108.462 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.2 p -76.18 146.95 8.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.2 t -86.33 156.86 20.05 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.066 0.547 . . . . 0.0 111.01 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -92.55 -8.51 44.17 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 111.179 0.066 . . . . 0.0 111.179 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -77.49 150.43 79.55 Favored Pre-proline 0 CA--C 1.529 0.144 0 C-N-CA 123.458 0.703 . . . . 0.0 110.637 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.58 -32.95 1.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.411 2.74 . . . . 0.0 112.484 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.03 159.89 11.57 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.364 0.666 . . . . 0.0 110.343 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 39.1 mt -91.09 122.68 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 39.1 mmm -76.11 160.48 78.12 Favored Pre-proline 0 N--CA 1.456 -0.158 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 170.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -49.11 117.56 2.92 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.752 2.301 . . . . 0.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -78.49 135.44 15.83 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 -169.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -78.32 164.13 25.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 168.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 33.4 t -143.78 159.12 43.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.961 0.8 . . . . 0.0 112.966 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -143.91 2.98 1.22 Allowed 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -177.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.4 -178.83 53.33 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 123.332 0.491 . . . . 0.0 112.009 -176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.7 mt -143.53 158.7 43.45 Favored 'General case' 0 C--N 1.334 -0.099 0 C-N-CA 123.631 0.772 . . . . 0.0 109.109 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -68.73 -14.26 62.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.21 0.204 . . . . 0.0 111.428 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -120.43 27.25 8.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.694 0.798 . . . . 0.0 111.536 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -176.58 -154.46 11.83 Favored Glycine 0 C--N 1.337 0.613 0 O-C-N 121.549 -0.719 . . . . 0.0 111.35 -178.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -132.97 -11.43 2.96 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.0 t -127.08 156.03 42.36 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.036 0.534 . . . . 0.0 110.279 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.1 p -122.7 3.74 9.52 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.598 0.759 . . . . 0.0 112.304 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -142.92 141.73 31.55 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 124.818 1.247 . . . . 0.0 114.331 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -155.13 156.68 36.21 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.963 -0.46 . . . . 0.0 111.382 -177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -119.84 132.54 55.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.695 1.198 . . . . 0.0 112.943 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -122.25 3.39 9.79 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 98.0 p -68.9 -17.57 63.99 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.568 0.347 . . . . 0.0 111.299 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -113.96 -1.58 13.77 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.306 0.642 . . . . 0.0 111.594 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.3 t -75.22 146.98 40.72 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.405 0.282 . . . . 0.0 110.941 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -76.29 -17.37 59.48 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.455 0.302 . . . . 0.0 110.792 178.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -65.74 -23.62 66.78 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.486 0.315 . . . . 0.0 110.787 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -68.49 113.55 6.13 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . 0.582 HH11 ' HG2' ' A' ' 481' ' ' ARG . 6.8 ttt-85 -81.08 -29.96 34.82 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 116.818 -0.173 . . . . 0.0 111.409 -172.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -89.01 7.46 34.68 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.1 t -71.38 -18.93 62.33 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.19 149.93 71.39 Favored Pre-proline 0 C--O 1.232 0.137 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.13 -24.52 27.91 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.026 2.484 . . . . 0.0 111.681 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -81.35 -22.68 38.24 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.164 0.438 . . . . 0.0 110.9 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.56 -39.21 17.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 122.097 -0.377 . . . . 0.0 110.019 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -69.01 -20.47 64.15 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.116 0.566 . . . . 0.0 111.443 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.42 -16.96 60.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.068 -0.395 . . . . 0.0 111.732 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -124.09 31.64 5.76 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.118 0.567 . . . . 0.0 111.773 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.89 156.84 6.2 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.311 0.577 . . . . 0.0 112.034 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.23 97.58 3.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.5 mm -137.12 136.9 47.08 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.04 0 C-N-CA 122.845 0.458 . . . . 0.0 110.096 -174.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -152.09 173.42 14.93 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 110.21 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -57.28 156.58 14.69 Favored Pre-proline 0 CA--C 1.531 0.22 0 C-N-CA 123.454 0.702 . . . . 0.0 109.928 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.13 150.82 87.54 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 122.947 2.431 . . . . 0.0 110.007 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.0 t -155.07 166.54 33.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 -174.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -83.71 -0.91 52.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.656 0.382 . . . . 0.0 110.55 179.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -96.27 138.19 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 177.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.1 mt -123.14 155.01 37.87 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.07 0.548 . . . . 0.0 109.662 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -119.14 142.12 48.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -136.55 158.94 43.25 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 121.506 0.67 . . . . 0.0 110.2 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -150.9 168.76 23.52 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 104.181 -2.526 . . . . 0.0 104.181 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 57.54 57.51 4.29 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.864 0.465 . . . . 0.0 110.847 -174.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -135.54 110.54 10.45 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.356 0.262 . . . . 0.0 110.826 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.66 165.78 1.59 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 124.693 3.595 . . . . 0.0 113.162 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 16.4 mt -68.37 -16.46 63.93 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.006 -176.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.93 -10.6 50.07 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -81.61 -13.88 12.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -171.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.86 178.89 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -167.405 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.702 ' H ' HG22 ' A' ' 510' ' ' THR . 87.1 tt0 4.56 -64.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.541 1.936 . . . . 0.0 114.671 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.3 mt-10 -57.06 -43.0 81.62 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.9 -27.0 21.28 Favored 'General case' 0 C--N 1.35 0.6 0 CA-C-N 122.667 2.485 . . . . 0.0 105.712 -176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -60.12 -37.64 80.63 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.63 -1.228 . . . . 0.0 113.275 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.57 -49.67 52.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -79.61 -21.42 44.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.83 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 57.0 mt -71.93 -40.4 68.2 Favored 'Isoleucine or valine' 0 C--N 1.338 0.099 0 CA-C-N 119.006 0.821 . . . . 0.0 109.589 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 98.7 m -64.58 -33.99 77.2 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.688 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -63.29 -40.26 96.87 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -73.73 -9.34 58.56 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.655 0.382 . . . . 0.0 111.997 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 87.9 mt -107.86 -2.66 19.67 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.452 0.701 . . . . 0.0 111.606 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.08 -13.23 5.83 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.593 -0.56 . . . . 0.0 113.431 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 35.4 m -81.48 154.8 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.088 0 CA-C-N 118.191 0.996 . . . . 0.0 109.26 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -75.8 148.73 38.22 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.062 -0.399 . . . . 0.0 111.336 -176.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 53.3 ptt85 -70.79 156.23 92.28 Favored Pre-proline 0 CA--C 1.53 0.177 0 C-N-CA 123.277 0.631 . . . . 0.0 109.936 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.26 151.29 83.8 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.238 2.625 . . . . 0.0 110.959 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.5 t -87.11 -14.95 39.88 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 23.2 t -151.46 154.86 37.41 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 122.489 0.316 . . . . 0.0 110.639 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 57.8 t -143.62 146.38 21.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 C-N-CA 123.702 0.801 . . . . 0.0 110.187 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -147.26 141.61 26.33 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.488 0.715 . . . . 0.0 109.476 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -137.37 149.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.75 -172.44 4.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 92.0 p -140.83 -177.25 4.99 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.54 0.736 . . . . 0.0 110.628 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.6 -8.76 66.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 123.825 0.726 . . . . 0.0 112.142 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.51 -27.01 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.83 0.815 . . . . 0.0 111.017 177.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 80.2 p -165.07 165.75 19.72 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.414 0.686 . . . . 0.0 109.619 176.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.4 pm0 -96.85 -5.72 37.58 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.057 0.543 . . . . 0.0 110.915 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -77.61 -47.43 19.35 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 88.1 p -163.05 172.65 14.65 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.145 0.498 . . . . 0.0 110.929 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 42.1 t -77.41 167.3 21.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.336 0.589 . . . . 0.0 111.174 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 91.9 p -148.48 163.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.32 -165.87 36.55 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 119.772 -1.204 . . . . 0.0 113.485 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.88 159.23 25.94 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.809 0.844 . . . . 0.0 110.474 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.1 mt -137.71 155.39 49.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.953 1.301 . . . . 0.0 108.134 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -145.8 147.42 31.84 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 118.147 0.43 . . . . 0.0 111.498 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -124.67 171.08 10.35 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.929 1.292 . . . . 0.0 112.075 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -73.07 -12.22 60.83 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 47.4 t -157.52 164.48 37.32 Favored 'General case' 0 C--O 1.231 0.119 0 O-C-N 121.806 -0.559 . . . . 0.0 111.097 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -70.78 -29.2 65.33 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.477 0.311 . . . . 0.0 110.713 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 82.3 p -76.25 -26.34 55.89 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 178.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.35 -36.93 74.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.968 0.507 . . . . 0.0 111.476 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.53 -28.51 56.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.465 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 52.0 tp -74.03 -40.88 62.57 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.23 -0.294 . . . . 0.0 111.235 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.64 -36.81 73.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.622 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 2.5 m -70.31 -27.71 64.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 176.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -65.23 -39.27 92.51 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.04 -47.22 75.33 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -84.51 -27.09 27.64 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 27.6 tp -93.66 -20.0 20.59 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -69.99 149.88 47.26 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.315 0.507 . . . . 0.0 110.211 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 57.31 22.65 7.98 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.738 1.215 . . . . 0.0 113.122 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -65.44 134.75 54.14 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 177.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -76.61 121.08 22.7 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.476 0.31 . . . . 0.0 110.707 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 68.3 mtm -90.4 152.62 20.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 123.131 0.573 . . . . 0.0 109.969 172.472 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.67 164.51 35.47 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.298 2.665 . . . . 0.0 111.002 176.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -129.94 142.32 50.66 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 102.997 -2.964 . . . . 0.0 102.997 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.25 0.8 OUTLIER -84.96 140.3 31.18 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 115.321 1.601 . . . . 0.0 115.321 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.7 tt -78.26 147.14 34.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.28 147.97 52.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.401 -0.519 . . . . 0.0 110.619 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.26 164.01 38.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.234 0.54 . . . . 0.0 111.245 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 24.6 p -162.24 175.33 11.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.269 1.028 . . . . 0.0 110.038 -178.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -57.97 125.83 24.82 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.9 t -81.83 150.64 27.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -172.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.27 0.7 OUTLIER -114.54 10.3 16.82 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.852 1.426 . . . . 0.0 114.852 169.836 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.63 163.4 21.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.215 1.006 . . . . 0.0 111.906 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -96.95 -0.78 46.96 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.437 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -155.09 168.56 26.61 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.629 0.772 . . . . 0.0 110.293 -178.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.92 20.46 1.44 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.492 0.717 . . . . 0.0 110.381 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.457 -1.259 . . . . 0.0 110.765 -175.564 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.455 -0.785 0 N-CA-C 111.183 -0.353 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -155.2 158.54 39.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.165 0.586 . . . . 0.0 110.422 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.83 160.61 31.88 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.873 0.368 . . . . 0.0 111.237 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -73.98 -6.6 48.34 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.3 t -158.85 146.93 13.7 Favored Pre-proline 0 N--CA 1.456 -0.138 0 C-N-CA 122.759 0.424 . . . . 0.0 110.49 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -12.74 34.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.492 2.795 . . . . 0.0 110.742 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.51 148.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 C-N-CA 122.846 0.458 . . . . 0.0 112.182 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.9 tt -140.28 155.71 46.74 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 14.5 tpt -139.05 131.61 28.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.241 0.473 . . . . 0.0 110.811 -174.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.26 155.12 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -144.8 175.11 10.43 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -176.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.24 9.62 81.7 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.071 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.81 26.79 0.4 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.467 0.707 . . . . 0.0 112.461 -177.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.6 -40.74 97.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.462 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.43 148.61 51.62 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.122 0.487 . . . . 0.0 111.201 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 67.3 m -70.08 -8.02 46.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -72.93 -15.4 61.57 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 122.58 0.352 . . . . 0.0 111.455 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 51.6 mmm -90.72 148.0 22.88 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.924 0.392 . . . . 0.0 110.814 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -162.23 159.75 26.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.296 1.038 . . . . 0.0 108.284 175.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.9 p -59.92 -30.77 69.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -74.99 -37.04 61.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.048 0.386 . . . . 0.0 111.779 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -70.81 -51.5 26.37 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 122.726 0.41 . . . . 0.0 110.231 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 38.1 t -69.08 -43.03 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.138 0.575 . . . . 0.0 109.743 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.29 -29.48 57.41 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -73.79 -33.67 64.32 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 120.124 1.329 . . . . 0.0 109.839 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . 0.411 HG22 ' CD2' ' A' ' 556' ' ' LEU . 17.6 t -57.31 -57.06 11.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.272 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.558 2.8 p90 -76.49 -4.03 40.48 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 117.758 2.503 . . . . 0.0 117.758 175.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.37 -33.15 58.91 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.881 -0.512 . . . . 0.0 111.085 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -60.81 -14.86 24.4 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -84.51 -9.78 58.03 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.17 -151.71 15.35 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.354 0.525 . . . . 0.0 112.233 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -99.57 126.15 45.5 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.551 0.34 . . . . 0.0 110.961 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.02 165.47 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.86 -62.76 1.22 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -144.28 161.17 39.6 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -169.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.14 150.32 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.45 1.1 . . . . 0.0 109.162 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -157.47 132.42 8.76 Favored 'General case' 0 CA--C 1.527 0.096 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.8 m-85 -82.89 163.66 20.98 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -122.43 123.14 40.63 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 122.838 0.455 . . . . 0.0 111.959 -177.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.006 0.523 . . . . 0.0 111.254 169.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.9 p -77.91 -7.76 57.18 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.292 0.637 . . . . 0.0 112.432 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -132.13 159.47 72.04 Favored Pre-proline 0 CA--C 1.529 0.147 0 C-N-CA 124.131 0.973 . . . . 0.0 109.319 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -16.43 54.87 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.92 2.413 . . . . 0.0 111.013 177.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 173.5 101.16 0.14 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.25 158.55 39.01 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.428 0.691 . . . . 0.0 109.75 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.19 153.88 29.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.008 0.433 . . . . 0.0 110.985 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.3 ttm -107.39 151.19 25.84 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.024 0.929 . . . . 0.0 108.749 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.7 t -136.83 152.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 123.299 0.639 . . . . 0.0 111.599 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -132.12 128.93 39.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.2 mtp -152.53 171.11 18.62 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -170.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.445 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.92 125.65 26.61 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 169.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -73.31 -29.63 62.83 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -63.94 -83.65 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 -178.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -72.66 -36.48 67.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.72 -33.32 18.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 119.944 1.247 . . . . 0.0 114.151 -169.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 52.5 t -88.88 -24.49 6.0 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.13 1.332 . . . . 0.0 109.858 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -70.84 -50.83 31.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -65.11 -35.21 80.4 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.36 77.55 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.576 0.625 . . . . 0.0 110.552 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 72.6 mt -79.91 -9.1 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.088 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 26.0 m -98.85 -20.18 16.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.17 -29.52 2.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -169.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.06 -13.09 7.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.623 1.556 . . . . 0.0 113.56 -173.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.7 p-10 -71.62 100.79 2.36 Favored 'General case' 0 C--O 1.201 -1.46 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -167.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.3 m-80 76.65 22.04 1.21 Allowed 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 123.666 2.939 . . . . 0.0 113.207 -162.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -79.25 163.19 25.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.494 -0.754 . . . . 0.0 109.425 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.39 135.94 36.27 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.6 ttt -157.67 142.61 16.7 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 59.55 18.5 7.07 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 116.53 2.048 . . . . 0.0 116.53 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.31 11.38 85.39 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 -174.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -134.51 -162.86 1.3 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.439 1.496 . . . . 0.0 108.474 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -136.86 149.72 47.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.95 0.405 . . . . 0.0 111.023 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 13.9 ptm -127.45 83.59 2.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.116 0.966 . . . . 0.0 108.873 178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -55.92 127.96 32.83 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-O 115.759 -2.067 . . . . 0.0 112.21 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.43 2.0 t -128.54 152.66 36.98 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 113.48 -3.288 . . . . 0.0 116.51 169.208 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -160.3 167.44 27.49 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.375 1.47 . . . . 0.0 107.974 177.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.23 146.4 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.5 t -83.03 166.02 19.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.827 0.451 . . . . 0.0 111.253 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.16 12.48 7.12 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -85.33 151.85 57.1 Favored Pre-proline 0 N--CA 1.456 -0.151 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.05 -36.56 4.21 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.789 2.326 . . . . 0.0 112.506 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.89 158.78 7.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.764 0.425 . . . . 0.0 111.42 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -75.31 130.53 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.5 mmm -97.08 118.6 64.59 Favored Pre-proline 0 N--CA 1.454 -0.254 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.512 175.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.19 163.45 32.69 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.167 2.578 . . . . 0.0 109.772 175.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.52 -144.52 12.35 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -72.45 152.32 42.03 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.373 0.669 . . . . 0.0 109.83 -179.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 89.1 p -151.92 166.19 32.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.989 0.424 . . . . 0.0 111.439 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -84.63 -4.42 58.99 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.68 -177.69 51.35 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.7 mt -141.85 157.44 45.0 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.977 0.911 . . . . 0.0 108.996 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -75.37 -12.03 60.17 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.364 -0.21 . . . . 0.0 111.452 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -120.4 26.64 9.07 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.668 0.787 . . . . 0.0 110.122 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.92 -154.19 8.56 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -177.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 41.6 t -133.05 -26.11 1.74 Allowed 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.613 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 98.0 m -127.01 155.96 42.38 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.485 0.714 . . . . 0.0 110.338 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.4 p -75.93 -23.08 55.42 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -95.26 148.49 22.36 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -157.15 157.49 34.54 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.088 0.555 . . . . 0.0 109.901 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -134.35 153.19 52.03 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -128.01 2.67 5.9 Favored 'General case' 0 CA--C 1.527 0.091 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.3 p -66.07 -17.73 64.88 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.6 0.36 . . . . 0.0 111.762 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.05 2.07 14.83 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.405 0.682 . . . . 0.0 111.321 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 39.9 t -82.33 -7.85 59.63 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.962 0.505 . . . . 0.0 112.014 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 62.4 -7.96 0.12 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.126 1.37 . . . . 0.0 113.155 -177.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . 0.504 HD21 ' CD2' ' A' ' 561' ' ' HIS . 63.9 m-20 -65.56 -15.8 63.07 Favored 'General case' 0 C--O 1.231 0.093 0 O-C-N 121.685 -0.635 . . . . 0.0 112.581 -178.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -55.56 125.34 20.61 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -72.97 -33.77 66.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -169.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.376 57.1 m-85 -98.19 8.15 45.22 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 117.946 2.573 . . . . 0.0 117.946 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.7 t -76.16 -13.78 60.18 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -132.44 149.56 73.46 Favored Pre-proline 0 C--O 1.231 0.087 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -71.58 -23.87 22.7 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.28 2.653 . . . . 0.0 111.624 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.56 -25.34 53.95 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.133 0.424 . . . . 0.0 110.317 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -86.68 -48.29 8.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -65.18 -19.53 66.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.476 0.71 . . . . 0.0 112.765 -171.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.62 -29.22 62.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.243 0.474 . . . . 0.0 111.388 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -124.06 10.25 8.77 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -60.46 154.51 20.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.663 0.665 . . . . 0.0 112.719 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -155.34 138.71 15.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 47.2 mt -142.12 142.74 27.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 C-N-CA 123.449 0.7 . . . . 0.0 109.511 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -148.27 173.39 13.07 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 123.801 0.841 . . . . 0.0 110.336 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -58.73 153.9 39.21 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.296 0.638 . . . . 0.0 110.049 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.22 147.44 88.07 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 123.087 2.525 . . . . 0.0 110.267 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.4 t -152.67 174.49 13.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.388 0.675 . . . . 0.0 109.771 -174.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -83.68 -0.64 51.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -178.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -99.71 136.45 30.9 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 552' ' ' ALA . 4.6 mm? -121.14 156.23 32.79 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.805 0.842 . . . . 0.0 109.644 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -127.1 142.35 51.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -136.6 158.95 43.24 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.305 0.574 . . . . 0.0 111.257 -176.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -150.16 164.49 35.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.403 -2.814 . . . . 0.0 103.403 -177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 34.0 m120 58.53 56.79 4.11 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.949 0.5 . . . . 0.0 111.104 -172.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -122.02 151.94 59.06 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.724 0.41 . . . . 0.0 111.174 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.57 154.26 37.45 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.467 2.778 . . . . 0.0 112.118 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.78 -16.55 63.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.98 0.512 . . . . 0.0 111.675 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -122.83 27.71 7.6 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 123.701 0.8 . . . . 0.0 110.968 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.8 p -63.64 -17.01 19.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.54 -177.91 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -164.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 22.7 pt-20 -21.34 -41.77 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.794 1.638 . . . . 0.0 115.215 -169.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.6 -47.2 82.81 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 172.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -86.3 -27.01 24.62 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 121.709 2.049 . . . . 0.0 106.631 -173.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -67.12 -36.26 81.52 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -76.84 -38.65 53.38 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -73.58 -28.66 61.96 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.398 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.66 -44.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 O-C-N 121.966 -0.459 . . . . 0.0 110.969 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 31.2 p -69.12 -25.44 64.4 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.183 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.96 -42.46 85.16 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -70.41 -18.3 63.02 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 70.8 mt -96.07 -6.01 39.62 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.653 0.381 . . . . 0.0 111.415 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.59 -11.87 3.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.875 0.75 . . . . 0.0 113.769 177.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 24.1 m -77.79 159.37 4.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 118.194 0.997 . . . . 0.0 110.45 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -68.9 153.68 43.36 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.113 0.482 . . . . 0.0 111.627 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -76.08 157.03 83.76 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.48 0.712 . . . . 0.0 110.692 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.26 160.09 51.2 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.343 2.696 . . . . 0.0 111.015 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -95.25 -15.75 22.98 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.1 t -154.22 159.99 41.61 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 122.793 0.437 . . . . 0.0 110.313 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.29 150.08 12.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -145.6 141.06 27.83 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 124.0 0.92 . . . . 0.0 109.071 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 25.0 t -139.9 141.46 34.12 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 C-N-CA 123.524 0.729 . . . . 0.0 110.023 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.67 167.23 29.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 -177.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 36.7 t -89.76 170.72 10.19 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.654 0.782 . . . . 0.0 110.763 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 92.27 -178.07 39.9 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 123.751 0.691 . . . . 0.0 112.048 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 41.0 mttm 62.53 -12.08 0.07 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.083 1.753 . . . . 0.0 113.698 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 44.5 t -165.6 162.02 18.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.451 0.701 . . . . 0.0 110.466 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -116.95 -5.78 11.46 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.376 0.67 . . . . 0.0 110.104 174.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -91.98 -31.32 15.66 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.747 0.819 . . . . 0.0 112.275 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.7 p -159.11 168.92 25.4 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 121.089 0.471 . . . . 0.0 111.563 -171.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 32.9 t -89.5 170.93 10.09 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.847 0.859 . . . . 0.0 110.97 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.5 t -148.65 159.87 43.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.245 1.018 . . . . 0.0 109.186 178.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.71 -171.79 44.42 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.001 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 159.8 27.05 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.813 0.845 . . . . 0.0 110.441 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.0 mt -140.87 159.22 42.68 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.675 1.19 . . . . 0.0 108.859 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -150.32 148.74 29.2 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 122.102 -0.374 . . . . 0.0 111.745 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -126.72 171.36 11.25 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.106 1.362 . . . . 0.0 112.075 178.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -74.59 -10.41 59.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.59 0.356 . . . . 0.0 110.567 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.2 t -157.66 157.13 32.99 Favored 'General case' 0 C--O 1.231 0.123 0 O-C-N 121.698 -0.626 . . . . 0.0 110.444 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -75.04 -19.69 59.91 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.019 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.1 m -80.84 -29.45 35.86 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 118.188 0.449 . . . . 0.0 110.181 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.99 -36.47 72.49 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 121.41 0.624 . . . . 0.0 111.219 171.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 500' ' ' LEU . . . -72.22 -27.01 62.26 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.663 177.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.2 tp -79.82 -45.22 19.13 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.596 0.358 . . . . 0.0 111.539 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.5 -33.46 75.97 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -73.81 -28.15 61.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 175.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' A' ' 399' ' ' VAL . 1.8 tt -70.38 -35.18 73.34 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 171.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -57.36 -49.45 72.74 Favored Glycine 0 C--N 1.335 0.519 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.305 35.1 m-85 -84.07 -11.78 56.16 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.395 2.739 . . . . 0.0 118.395 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.15 -20.68 14.07 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.823 0.738 . . . . 0.0 112.859 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -70.64 139.39 51.31 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 119.315 0.962 . . . . 0.0 109.532 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.504 ' CD2' HD21 ' A' ' 479' ' ' ASN . 2.4 t-80 55.96 17.12 2.43 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.031 1.332 . . . . 0.0 113.444 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 32.7 t80 -72.68 139.4 47.25 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -69.7 140.76 53.57 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.958 -0.464 . . . . 0.0 112.193 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.4 mtm -83.57 152.66 24.74 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.921 0.391 . . . . 0.0 111.362 175.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 172.176 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.82 159.17 48.94 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.381 2.721 . . . . 0.0 111.196 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -130.01 142.32 50.64 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 102.731 -3.062 . . . . 0.0 102.731 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.263 0.6 OUTLIER -76.55 141.46 41.17 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 -176.271 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.41 138.15 32.99 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.3 1.44 . . . . 0.0 107.658 173.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 150.08 51.71 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 118.091 0.405 . . . . 0.0 110.308 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.25 162.79 40.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.173 0.511 . . . . 0.0 111.247 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.6 p -158.57 167.6 29.16 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.823 0.849 . . . . 0.0 110.378 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -56.0 122.91 12.69 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.1 t -80.12 153.38 28.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -169.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 t -119.05 12.43 12.73 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.16 0.984 . . . . 0.0 113.434 169.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.03 20.19 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.138 0.975 . . . . 0.0 111.88 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -92.62 -3.49 54.88 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.571 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -153.9 171.49 18.9 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.75 0.82 . . . . 0.0 110.436 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.63 24.91 0.97 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.471 0.708 . . . . 0.0 110.198 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.604 -1.188 . . . . 0.0 110.439 -176.629 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 N--CA 1.454 -0.834 0 CA-C-O 121.09 0.371 . . . . 0.0 112.724 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -150.17 155.71 40.27 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.016 0.526 . . . . 0.0 110.569 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.83 161.15 29.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -76.61 -8.83 58.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.771 0.428 . . . . 0.0 110.272 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -157.29 147.77 16.03 Favored Pre-proline 0 CA--C 1.527 0.086 0 O-C-N 121.7 -0.625 . . . . 0.0 110.74 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.91 -17.21 46.57 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.239 2.626 . . . . 0.0 110.539 173.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.1 151.49 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -141.38 155.12 45.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.676 1.19 . . . . 0.0 108.338 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 43.9 tpp -136.63 137.52 40.19 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.343 0.257 . . . . 0.0 110.827 -176.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -131.69 150.91 34.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -138.04 175.69 9.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 12.34 77.73 Favored Glycine 0 CA--C 1.528 0.892 0 N-CA-C 112.014 -0.434 . . . . 0.0 112.014 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.22 25.95 0.57 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.343 0.657 . . . . 0.0 111.655 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -64.86 -40.21 94.79 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -176.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 388' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.1 pm0 -67.94 147.85 51.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.0 0.429 . . . . 0.0 110.582 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 49.9 m -70.54 -8.47 51.64 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -72.95 -17.19 61.5 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.124 0.42 . . . . 0.0 111.42 178.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 66.3 mmm -85.18 148.14 26.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.088 0.403 . . . . 0.0 110.588 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.38 155.52 22.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.9 p -61.29 -30.56 70.56 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -72.45 -39.46 67.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.763 0.316 . . . . 0.0 110.559 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -76.06 -41.18 51.48 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 t -71.06 -43.65 75.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -75.1 -30.01 60.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . 0.409 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.4 p30 -78.23 -28.31 47.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.018 1.281 . . . . 0.0 110.234 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 399' ' ' VAL . . . . . 0.49 HG22 HD12 ' A' ' 556' ' ' LEU . 2.4 t -59.53 -57.02 13.43 Favored 'Isoleucine or valine' 0 C--N 1.341 0.222 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -178.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.551 1.6 p90 -76.65 -5.71 49.03 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 401' ' ' CYS . . . . . 0.409 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 48.7 t -71.37 -32.27 68.29 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 117.973 0.351 . . . . 0.0 110.609 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -62.59 -14.99 48.97 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 120.321 -0.551 . . . . 0.0 111.279 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -90.5 -2.16 57.91 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 117.811 2.523 . . . . 0.0 117.811 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.0 -170.16 40.59 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.748 0.703 . . . . 0.0 113.054 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -83.07 132.62 35.11 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.54 -0.388 . . . . 0.0 110.797 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.94 165.53 8.82 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.096 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -177.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -122.49 -68.83 0.86 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.423 0.289 . . . . 0.0 111.522 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -154.54 174.44 14.93 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.219 0.463 . . . . 0.0 112.091 -177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.47 149.94 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 C-N-CA 124.426 1.09 . . . . 0.0 109.531 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -155.27 130.21 9.38 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.854 0.461 . . . . 0.0 111.314 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.279 3.7 m-85 -80.98 152.09 28.15 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 178.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 412' ' ' MET . . . . . 0.461 ' HE3' ' HG3' ' A' ' 420' ' ' MET . 34.7 mmt -73.5 134.17 43.8 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-O 121.111 0.481 . . . . 0.0 111.808 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -79.21 -33.96 43.29 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.898 0.879 . . . . 0.0 111.974 178.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 70.7 m -102.05 -17.91 15.85 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -174.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -91.74 150.27 40.59 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 118.445 0.566 . . . . 0.0 110.562 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.18 -12.81 23.42 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.668 2.912 . . . . 0.0 112.432 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.82 81.42 0.06 OUTLIER Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.334 -0.706 . . . . 0.0 111.334 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.69 161.34 39.85 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.062 0.545 . . . . 0.0 109.87 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.95 149.28 19.54 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 420' ' ' MET . . . . . 0.461 ' HG3' ' HE3' ' A' ' 412' ' ' MET . 78.5 mtp -93.6 151.51 19.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.973 0.909 . . . . 0.0 109.588 172.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.0 t -143.9 154.24 15.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -138.71 133.79 32.72 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 28.1 mtm -153.24 175.59 12.9 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 124.238 1.015 . . . . 0.0 109.5 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 424' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.45 123.57 19.56 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 172.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -72.43 -32.41 66.3 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -167.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.83 -89.39 0.01 OUTLIER Glycine 0 C--N 1.339 0.705 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -71.68 -29.12 64.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.47 -35.15 18.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.765 -172.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 55.8 t -89.3 -26.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 118.319 -1.352 . . . . 0.0 109.447 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -68.56 -49.27 60.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.064 175.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -70.41 -31.37 68.54 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.66 78.31 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.876 0.762 . . . . 0.0 110.213 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.04 -15.59 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.121 0.569 . . . . 0.0 110.882 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.7 m -91.01 -20.66 21.86 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -123.46 -29.55 3.77 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 -169.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.0 mt -134.42 -5.53 2.59 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -171.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' ASN . . . . . 0.64 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.65 100.99 2.42 Favored 'General case' 0 C--O 1.204 -1.341 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -169.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.9 m-80 77.21 22.06 1.02 Allowed 'General case' 0 N--CA 1.483 1.216 0 O-C-N 117.713 -3.117 . . . . 0.0 113.019 -160.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -83.08 156.96 23.04 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.946 -1.096 . . . . 0.0 109.752 167.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.252 21.8 m-85 -74.71 142.59 44.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 28.2 ttt -161.51 140.16 9.66 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.433 0.693 . . . . 0.0 109.901 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.386 47.7 m-85 56.83 27.21 12.57 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 117.77 2.508 . . . . 0.0 117.77 -179.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.7 7.56 88.12 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -133.71 -163.49 1.37 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.953 1.301 . . . . 0.0 108.211 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -138.88 146.33 41.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.29 107.31 10.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 447' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 3.6 m-20 -69.35 133.92 48.42 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 115.653 -2.118 . . . . 0.0 111.813 -171.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 448' ' ' VAL . . . . . 0.64 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.465 2.0 t -125.11 151.18 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 113.191 -3.404 . . . . 0.0 115.132 168.44 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.7 t -161.48 165.98 27.85 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.807 1.243 . . . . 0.0 108.269 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.1 p -70.98 148.32 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.9 t -85.52 159.79 19.82 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.963 0.505 . . . . 0.0 110.969 177.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -105.13 0.02 27.04 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 121.948 0.099 . . . . 0.0 111.144 177.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -82.16 149.68 62.9 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.46 0.704 . . . . 0.0 110.507 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.02 -34.27 2.31 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.225 2.617 . . . . 0.0 112.148 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.11 158.75 12.43 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.366 0.666 . . . . 0.0 110.452 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.7 mt -85.09 135.86 23.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 174.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 60.4 mmm -98.8 156.69 35.3 Favored Pre-proline 0 N--CA 1.454 -0.258 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.24 118.69 5.11 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.883 2.388 . . . . 0.0 110.418 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -84.77 142.8 20.3 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 -176.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -77.74 125.6 29.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.6 p -77.79 153.39 32.89 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.864 0.364 . . . . 0.0 111.194 -176.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -139.83 -5.82 1.32 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.87 118.32 0.24 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.278 0.942 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.3 mt -77.36 160.22 28.94 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -69.3 -15.42 63.34 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 122.126 -0.359 . . . . 0.0 111.671 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -120.47 24.9 10.11 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.29 0.636 . . . . 0.0 110.186 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.94 -160.31 12.24 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 121.698 -0.626 . . . . 0.0 111.698 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 71.9 m -132.97 -5.54 3.11 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 95.1 m -127.03 155.67 42.86 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.162 0.585 . . . . 0.0 110.778 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.1 m -121.23 4.34 10.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.165 0.586 . . . . 0.0 110.34 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -144.82 147.77 33.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.517 1.127 . . . . 0.0 112.619 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -154.15 154.25 33.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.189 0.449 . . . . 0.0 111.374 -177.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -128.41 139.83 52.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.216 1.006 . . . . 0.0 113.387 -177.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -126.59 5.46 6.81 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 40.9 t -64.26 -27.03 68.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.713 0.405 . . . . 0.0 111.663 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -100.85 -1.36 34.92 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 122.918 0.487 . . . . 0.0 111.601 178.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.9 t -81.56 149.57 28.59 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.125 -0.36 . . . . 0.0 111.457 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -87.5 -4.94 58.99 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.215 0.606 . . . . 0.0 111.208 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -63.34 -19.15 64.37 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -62.18 109.15 1.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.199 0.6 . . . . 0.0 109.606 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -73.99 -29.27 61.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.305 69.7 m-85 -97.98 15.14 24.95 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.3 t -74.22 -14.76 60.98 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -131.06 148.37 70.0 Favored Pre-proline 0 C--O 1.233 0.214 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -177.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -72.27 -26.25 17.77 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.278 2.652 . . . . 0.0 112.063 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -79.09 -27.93 43.02 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.495 0.589 . . . . 0.0 110.007 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -77.28 -43.97 31.39 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 175.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.48 -19.24 63.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.69 -18.1 42.13 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 -1.48 8.26 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.28 162.05 15.5 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.257 0.551 . . . . 0.0 111.673 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.16 140.98 27.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.562 0.745 . . . . 0.0 109.75 178.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 33.5 mm -143.8 138.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -149.55 173.38 13.68 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.512 0.725 . . . . 0.0 110.361 -177.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -58.74 155.06 32.7 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -64.54 151.79 84.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.839 2.359 . . . . 0.0 109.351 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -154.51 169.17 24.43 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.793 0.437 . . . . 0.0 110.042 -174.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -83.77 -8.03 59.33 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.92 145.18 8.6 Favored 'Isoleucine or valine' 0 C--N 1.339 0.112 0 C-N-CA 123.34 0.656 . . . . 0.0 111.887 173.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.0 tp -138.05 153.16 49.36 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -126.95 148.38 50.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.678 0.791 . . . . 0.0 109.103 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -144.53 160.77 40.58 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.555 0.693 . . . . 0.0 109.746 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -152.75 164.9 36.9 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 104.01 -2.589 . . . . 0.0 104.01 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 59.11 57.6 3.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.919 0.488 . . . . 0.0 111.971 -173.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.44 153.52 53.85 Favored Pre-proline 0 CA--C 1.532 0.268 0 C-N-CA 123.042 0.537 . . . . 0.0 110.454 177.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.07 159.19 54.11 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.373 2.049 . . . . 0.0 110.229 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.46 -16.53 63.93 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.603 0.361 . . . . 0.0 111.498 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -109.27 19.04 19.86 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.248 0.619 . . . . 0.0 111.449 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 3.8 p -63.26 -18.91 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.079 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -175.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.607 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.86 -177.38 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 117.852 -1.07 . . . . 0.0 113.772 -165.541 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' GLU . . . . . 0.607 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -25.92 -37.9 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -169.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.2 mt-10 -58.21 -48.08 81.48 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 117.142 -1.409 . . . . 0.0 114.451 171.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -86.63 -27.14 24.0 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 122.529 2.422 . . . . 0.0 106.686 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -65.09 -38.59 91.2 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 176.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -74.88 -37.84 62.04 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -80.43 -22.05 41.57 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.542 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 50.3 mt -76.38 -43.89 35.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.418 0.554 . . . . 0.0 110.671 177.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 29.3 p -69.28 -33.92 73.95 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.729 0.695 . . . . 0.0 110.307 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -72.46 -26.2 61.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.2 tp10 -75.27 -26.71 58.99 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.284 0.234 . . . . 0.0 110.626 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -95.96 -2.9 46.11 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.231 0.613 . . . . 0.0 111.738 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 77.06 -1.19 64.45 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 123.416 0.532 . . . . 0.0 112.832 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.92 151.6 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 CA-C-N 117.995 0.897 . . . . 0.0 111.74 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -67.15 150.18 49.49 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.017 0.437 . . . . 0.0 110.38 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -76.98 152.61 82.54 Favored Pre-proline 0 CA--C 1.531 0.221 0 C-N-CA 123.012 0.525 . . . . 0.0 110.716 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.93 156.85 61.88 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.533 2.822 . . . . 0.0 110.631 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -89.71 -18.09 27.06 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 37.8 t -154.64 160.64 41.55 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 120.494 0.188 . . . . 0.0 110.842 176.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.81 146.54 9.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -177.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -147.23 141.13 25.86 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.051 0.941 . . . . 0.0 109.068 172.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.77 151.86 28.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -155.81 177.24 11.62 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 38.0 t -141.95 165.54 27.17 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.566 0.746 . . . . 0.0 109.859 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 123.96 -19.46 7.35 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.679 0.657 . . . . 0.0 111.636 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -80.24 -23.92 40.53 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.645 0.722 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 47.6 t -164.86 157.46 16.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.764 0.826 . . . . 0.0 109.487 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -97.0 -4.71 39.29 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.431 0.292 . . . . 0.0 110.257 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -78.13 -36.53 47.75 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.9 p -161.11 167.69 25.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.436 0.636 . . . . 0.0 112.325 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 48.4 t -85.56 164.99 17.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.223 1.009 . . . . 0.0 110.738 176.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 93.6 p -150.21 162.44 40.47 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.217 1.007 . . . . 0.0 108.414 177.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.94 -169.01 42.15 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.663 -178.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -121.12 160.23 24.15 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.978 0.911 . . . . 0.0 110.423 -177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.6 mt -142.12 163.97 31.43 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.14 1.376 . . . . 0.0 109.047 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -153.69 147.28 25.1 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.331 -0.231 . . . . 0.0 111.33 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.4 m-90 -126.15 172.53 9.95 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.164 1.386 . . . . 0.0 112.33 177.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -73.5 -7.78 53.22 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 39.9 t -159.64 162.05 35.11 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 122.963 0.505 . . . . 0.0 110.674 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -69.29 -30.94 69.14 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.346 -0.221 . . . . 0.0 110.55 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.6 m -75.65 -23.36 56.3 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 122.087 0.155 . . . . 0.0 110.784 178.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -74.09 -36.36 64.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.016 0.436 . . . . 0.0 111.66 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.04 -26.39 56.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.292 176.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.9 tp -78.46 -37.55 43.22 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.367 0.267 . . . . 0.0 111.421 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -72.68 -38.25 67.64 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.16 -27.14 63.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 175.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' LEU . . . . . 0.541 ' C ' HD13 ' A' ' 556' ' ' LEU . 1.1 tm? -66.94 -41.73 86.46 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.17 -31.63 79.64 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 119.691 -0.505 . . . . 0.0 112.307 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.273 6.2 m-85 -94.52 -10.0 33.57 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 177.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 89.6 mt -119.86 -8.94 9.78 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -70.48 139.15 51.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.516 1.053 . . . . 0.0 109.289 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 58.75 17.83 5.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.997 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 29.2 t80 -68.89 138.34 54.59 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -74.0 136.6 43.19 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.782 -0.574 . . . . 0.0 112.29 -174.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.0 mtm -83.64 152.69 24.66 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.026 0.53 . . . . 0.0 111.79 175.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 170.477 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.0 p90 . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.39 167.23 27.82 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.589 2.859 . . . . 0.0 110.71 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -129.96 142.38 50.65 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 102.178 -3.267 . . . . 0.0 102.178 175.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.285 0.6 OUTLIER -82.42 138.48 34.41 Favored 'General case' 0 C--O 1.23 0.062 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -173.79 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' LEU . . . . . 0.406 HD13 ' C ' ' A' ' 575' ' ' LEU . 1.3 tm? -81.17 137.52 35.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.279 1.431 . . . . 0.0 107.694 172.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.89 147.47 52.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.46 161.1 40.08 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.946 0.403 . . . . 0.0 111.083 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.73 173.68 12.57 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.8 0.84 . . . . 0.0 110.33 -177.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -53.98 124.5 15.69 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 36.6 t -77.02 153.4 34.5 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 -171.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.261 1.0 OUTLIER -123.62 9.07 8.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.719 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.96 163.87 16.29 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.494 0.718 . . . . 0.0 110.704 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -82.83 0.58 43.31 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.41 165.37 1.4 Allowed 'General case' 0 C--O 1.23 0.029 0 C-N-CA 124.536 1.134 . . . . 0.0 110.196 175.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -84.29 -6.68 59.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.394 -1.289 . . . . 0.0 111.294 -179.483 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.306 35.1 t80 . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -73.77 167.86 54.29 Favored Glycine 0 CA--C 1.531 1.085 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -71.38 176.19 8.32 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.617 3.545 . . . . 0.0 110.978 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -145.4 157.94 43.93 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.917 0.487 . . . . 0.0 110.851 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.75 156.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -76.37 0.88 17.93 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -157.43 146.72 15.0 Favored Pre-proline 0 CA--C 1.53 0.18 0 C-N-CA 122.741 0.417 . . . . 0.0 110.699 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.74 -10.7 29.85 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 123.239 2.626 . . . . 0.0 111.073 173.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.98 155.77 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.617 0.767 . . . . 0.0 112.386 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -137.98 154.4 49.35 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.333 1.053 . . . . 0.0 109.309 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 82.3 mmm -126.01 142.41 51.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 123.399 0.68 . . . . 0.0 111.836 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -136.24 148.69 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.443 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 10.7 m-85 -140.74 174.28 10.67 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 -175.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.55 10.11 82.24 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 45.3 mt -80.45 25.96 0.39 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.531 0.732 . . . . 0.0 112.239 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.51 -39.78 94.42 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -67.58 150.62 48.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.122 0.487 . . . . 0.0 111.217 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 87.6 p -69.06 -8.75 48.04 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -77.27 -17.06 58.69 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 117.92 0.327 . . . . 0.0 111.3 -176.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 65.4 mmm -88.29 145.43 25.85 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.943 0.338 . . . . 0.0 110.422 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -160.92 158.32 27.98 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.8 p -60.28 -30.93 69.78 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -174.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -70.4 -41.54 72.85 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 177.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.96 -42.47 48.34 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.52 -174.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -69.37 -43.01 81.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -176.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.28 -30.81 57.94 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.025 -169.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -76.97 -30.77 56.12 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 119.914 1.234 . . . . 0.0 110.101 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.84 -55.76 21.84 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.559 1.3 p90 -76.51 -4.72 44.19 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 117.679 2.474 . . . . 0.0 117.679 173.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.1 t -72.74 -32.36 65.62 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 122.144 -0.347 . . . . 0.0 110.414 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.39 -17.19 52.97 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.49 177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -88.5 -4.53 58.59 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.99 176.03 33.65 Favored Glycine 0 CA--C 1.529 0.948 0 CA-C-N 118.605 0.639 . . . . 0.0 112.431 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.93 134.22 49.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 122.539 -0.389 . . . . 0.0 111.698 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.02 165.47 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 124.614 1.166 . . . . 0.0 113.65 -179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -121.49 -65.36 1.14 Allowed 'General case' 0 N--CA 1.457 -0.077 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.183 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -154.47 167.02 31.44 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.1 p -138.64 150.24 23.91 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 C-N-CA 124.031 0.933 . . . . 0.0 110.136 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -151.41 125.4 9.2 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.066 0.547 . . . . 0.0 110.988 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -85.3 157.65 20.51 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.3 ptp -136.39 135.64 38.94 Favored 'General case' 0 C--N 1.338 0.072 0 CA-C-O 121.948 0.88 . . . . 0.0 112.487 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 413' ' ' LYS . 11.8 ptmm? -79.13 -5.7 54.77 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 126.061 1.744 . . . . 0.0 112.769 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.8 t -77.76 -4.12 44.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.918 0.326 . . . . 0.0 111.823 -171.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.446 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 44.0 mmtm -141.74 157.36 65.02 Favored Pre-proline 0 CA--C 1.53 0.198 0 C-N-CA 124.159 0.983 . . . . 0.0 109.255 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.42 -11.91 33.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.177 2.585 . . . . 0.0 112.037 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.86 93.3 0.09 OUTLIER Glycine 0 C--N 1.336 0.574 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 175.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.5 162.78 39.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.788 0.435 . . . . 0.0 110.708 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.33 170.87 21.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.963 0.505 . . . . 0.0 110.243 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 21.6 ptm -131.97 152.23 51.24 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.695 0.798 . . . . 0.0 109.181 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.4 t -138.55 150.49 24.05 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.208 0 C-N-CA 123.184 0.594 . . . . 0.0 112.236 -173.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -129.06 131.09 47.27 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 46.0 mtp -152.87 174.89 13.52 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.588 0.755 . . . . 0.0 109.439 -170.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.468 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.66 115.5 7.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.5 p30 -72.24 -32.6 66.85 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -167.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.94 -86.47 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.609 -0.996 . . . . 0.0 110.609 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -74.65 -27.08 60.27 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 117.125 2.268 . . . . 0.0 117.125 -176.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.84 -35.2 17.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.074 -174.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 85.8 t -86.41 -27.21 6.07 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 CA-C-N 119.776 1.171 . . . . 0.0 108.818 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -66.19 -50.79 62.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.036 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -70.35 -30.56 67.55 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.54 -33.92 76.75 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 118.65 0.659 . . . . 0.0 110.168 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 52.5 mt -80.1 -16.84 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.472 0.709 . . . . 0.0 110.782 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -90.22 -19.71 23.85 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -126.14 -28.53 3.13 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 91.2 mt -134.38 -8.35 2.56 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.54 1.518 . . . . 0.0 114.911 -170.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.06 2.45 Favored 'General case' 0 C--O 1.202 -1.418 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.4 m-80 79.4 20.75 0.66 Allowed 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 124.281 3.219 . . . . 0.0 114.058 -161.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -75.71 162.99 27.75 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.065 -1.022 . . . . 0.0 110.641 167.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -80.0 140.16 36.69 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 175.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.1 ttt -160.41 138.4 9.84 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.831 0.852 . . . . 0.0 109.957 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 52.6 m-85 56.99 24.21 9.22 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.59 9.46 86.4 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.661 -0.575 . . . . 0.0 111.661 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -135.18 -168.91 2.27 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.905 1.282 . . . . 0.0 108.716 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -122.0 151.85 40.37 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.653 0.263 . . . . 0.0 111.221 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 10.5 ptm -127.25 75.74 1.61 Allowed 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 124.873 1.269 . . . . 0.0 109.203 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -53.35 128.1 27.19 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 115.482 -2.199 . . . . 0.0 112.266 -173.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.428 2.0 t -126.64 150.87 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.439 -3.304 . . . . 0.0 115.76 168.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -164.74 170.27 15.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.645 1.178 . . . . 0.0 109.71 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.0 t -74.53 145.54 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 45.4 t -86.15 170.04 12.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.55 0.74 . . . . 0.0 111.414 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -115.98 0.72 13.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.554 0.342 . . . . 0.0 110.479 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -76.24 150.15 82.61 Favored Pre-proline 0 CA--C 1.53 0.183 0 C-N-CA 123.685 0.794 . . . . 0.0 110.94 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.91 -38.48 1.22 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.953 2.435 . . . . 0.0 111.522 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.93 159.54 7.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.719 0.808 . . . . 0.0 110.213 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 50.8 mt -78.36 143.94 11.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.077 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 82.1 mtp -120.22 130.37 24.88 Favored Pre-proline 0 CA--C 1.528 0.112 0 CA-C-N 117.622 0.192 . . . . 0.0 111.498 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.34 170.09 20.07 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 124.033 3.155 . . . . 0.0 109.612 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.17 -123.91 1.78 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -72.42 157.89 36.79 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.035 0.534 . . . . 0.0 109.738 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 91.9 p -151.93 174.08 14.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.834 0.454 . . . . 0.0 110.273 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.97 3.25 4.05 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.82 -175.05 54.65 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 -176.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 78.7 mt -143.94 166.46 24.9 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.332 1.053 . . . . 0.0 109.328 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.81 -30.42 68.98 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 122.304 -0.248 . . . . 0.0 110.821 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -120.46 13.7 11.84 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -147.41 163.12 28.73 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 -178.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.8 t -86.57 -32.34 20.71 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.66 0.384 . . . . 0.0 111.703 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.5 m -127.1 155.63 43.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.3 0.64 . . . . 0.0 111.296 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.9 p -79.17 3.31 18.09 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.7 0.4 . . . . 0.0 110.778 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -136.04 149.71 48.89 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -152.99 151.83 30.72 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.39 0.276 . . . . 0.0 110.597 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -121.58 137.83 54.57 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -130.89 4.34 4.5 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 94.7 p -66.76 -16.09 64.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.104 0.562 . . . . 0.0 111.997 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -114.08 1.29 14.57 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.117 0.567 . . . . 0.0 111.322 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.5 t -77.96 149.0 34.2 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.785 0.434 . . . . 0.0 111.483 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 478' ' ' ARG . 12.6 ttp180 -81.69 -8.02 59.66 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.737 0.415 . . . . 0.0 110.87 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . 0.452 HD21 ' CD2' ' A' ' 561' ' ' HIS . 6.5 m-20 -62.38 -21.58 65.46 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 122.386 0.274 . . . . 0.0 111.695 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -61.91 112.77 2.45 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -30.05 59.94 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.286 66.6 m-85 -97.98 11.94 35.84 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -74.53 -13.83 60.73 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -134.58 149.27 70.45 Favored Pre-proline 0 C--N 1.338 0.102 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -71.78 -24.73 21.08 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 123.211 2.607 . . . . 0.0 111.797 -177.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -76.84 -16.78 59.33 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.232 0.469 . . . . 0.0 110.584 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 63.1 mm-40 -92.53 -45.71 7.98 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 173.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.13 -18.69 61.6 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.798 0.439 . . . . 0.0 112.177 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.12 -22.79 44.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -124.09 -0.66 8.34 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -61.4 156.8 18.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.377 0.535 . . . . 0.0 111.143 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -150.85 139.75 20.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.4 mm -140.61 138.18 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.725 0.81 . . . . 0.0 109.293 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -150.21 173.37 14.01 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.625 0.77 . . . . 0.0 110.052 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -60.51 152.86 63.91 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 122.926 0.49 . . . . 0.0 109.908 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.61 159.34 51.38 Favored 'Trans proline' 0 N--CA 1.449 -1.124 0 C-N-CA 123.209 2.606 . . . . 0.0 110.352 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 93.9 p -156.59 177.52 11.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -83.75 -2.67 56.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.03 143.41 11.26 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 123.756 0.822 . . . . 0.0 112.376 175.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.32 149.61 47.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -120.41 151.39 39.36 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.517 0.727 . . . . 0.0 109.199 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -144.0 159.32 42.8 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.41 0.624 . . . . 0.0 112.018 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -149.17 167.76 25.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 102.99 -2.967 . . . . 0.0 102.99 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 56.68 57.49 4.74 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 122.226 -0.296 . . . . 0.0 111.182 -174.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -128.91 152.07 78.5 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.859 0.464 . . . . 0.0 110.597 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.78 154.51 31.48 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.515 2.81 . . . . 0.0 113.132 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.4 -16.48 63.93 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.494 0.718 . . . . 0.0 111.66 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -122.95 24.75 8.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.441 0.696 . . . . 0.0 110.835 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.03 -9.56 10.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -175.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.597 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.73 -177.32 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -165.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.597 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -28.64 -35.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.8 mt-10 -58.87 -46.3 88.14 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 116.915 -1.517 . . . . 0.0 114.553 170.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -87.66 -27.6 22.36 Favored 'General case' 0 C--N 1.354 0.792 0 CA-C-N 122.826 2.557 . . . . 0.0 106.861 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -66.65 -32.45 73.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.65 -46.26 39.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -76.44 -24.4 53.92 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.626 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.6 mt -74.91 -44.38 45.04 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 118.588 0.631 . . . . 0.0 110.203 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 86.4 m -66.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.53 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -69.54 -24.02 63.66 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -77.47 -30.89 53.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.266 0.227 . . . . 0.0 110.668 175.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 94.0 mt -86.17 -3.66 59.01 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.028 0.531 . . . . 0.0 111.141 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.04 -3.11 62.59 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 123.35 0.5 . . . . 0.0 112.377 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.8 t -77.36 148.47 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 CA-C-N 117.696 0.748 . . . . 0.0 111.825 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.94 133.97 51.99 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -75.37 152.67 85.82 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.727 0.411 . . . . 0.0 110.03 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -65.06 153.18 79.53 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.335 2.69 . . . . 0.0 111.579 -178.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -83.88 -14.75 50.35 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 33.5 t -152.36 153.8 34.35 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 122.478 0.311 . . . . 0.0 110.321 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 60.9 t -145.81 145.94 19.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 C-N-CA 123.44 0.696 . . . . 0.0 110.958 -175.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -146.45 145.23 30.15 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.645 0.778 . . . . 0.0 109.461 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 10.7 t -143.52 144.21 23.62 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.72 -173.08 4.44 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.9 p -139.05 -179.24 5.73 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.95 0.9 . . . . 0.0 110.157 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.37 -9.62 67.14 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 123.74 0.686 . . . . 0.0 112.232 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -88.51 -26.26 22.13 Favored 'General case' 0 C--N 1.338 0.109 0 CA-C-N 117.816 0.808 . . . . 0.0 110.281 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.4 t -165.62 152.66 10.24 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.908 0.883 . . . . 0.0 109.441 177.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -97.12 -6.02 35.96 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.526 0.33 . . . . 0.0 110.49 175.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.83 -26.64 16.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.177 0.591 . . . . 0.0 111.509 -176.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 25.9 t -159.66 161.8 35.03 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.143 0.429 . . . . 0.0 111.261 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 22.9 t -88.4 170.94 10.5 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.833 0.853 . . . . 0.0 111.932 -177.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.4 t -152.49 160.01 43.28 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.636 1.175 . . . . 0.0 109.204 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.38 -173.49 46.22 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.351 -0.452 . . . . 0.0 112.643 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.51 160.22 26.06 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.584 0.754 . . . . 0.0 110.728 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.2 mt -139.12 162.65 34.43 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 125.265 1.426 . . . . 0.0 108.907 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -152.55 146.85 25.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 122.284 -0.26 . . . . 0.0 111.144 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.5 m-90 -122.72 171.81 8.89 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.788 1.235 . . . . 0.0 112.526 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -77.48 -7.77 56.72 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.915 0.486 . . . . 0.0 111.134 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 38.6 t -155.47 159.58 39.9 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.639 -0.663 . . . . 0.0 111.402 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.52 -34.19 73.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.818 0.447 . . . . 0.0 110.521 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 73.5 m -75.55 -23.83 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.093 0.157 . . . . 0.0 110.785 178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -71.79 -35.93 70.15 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.69 -28.75 60.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.525 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.42 -38.77 55.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.697 0.399 . . . . 0.0 111.561 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -72.31 -36.2 68.84 Favored 'General case' 0 C--O 1.233 0.187 0 O-C-N 121.697 -0.627 . . . . 0.0 109.51 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -69.27 -20.48 63.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.9 -40.18 79.29 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 173.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.32 -39.35 95.86 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-O 119.792 -0.449 . . . . 0.0 111.984 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . 0.429 ' C ' HD22 ' A' ' 559' ' ' LEU 0.26 6.6 m-85 -88.52 -16.41 32.73 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.279 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 558' ' ' PHE . 4.2 mm? -115.01 -9.07 12.43 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -72.4 147.55 46.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.783 1.174 . . . . 0.0 109.588 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.452 ' CD2' HD21 ' A' ' 479' ' ' ASN . 1.9 t-80 57.24 17.53 3.67 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.257 1.023 . . . . 0.0 113.211 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 37.0 t80 -70.1 138.75 52.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 178.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.98 133.74 41.63 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.076 -0.39 . . . . 0.0 111.875 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.6 mtm -83.68 152.43 24.75 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.626 0.371 . . . . 0.0 111.156 175.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -90.4 152.81 20.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -135.1 145.84 55.96 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.393 0.677 . . . . 0.0 109.917 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.62 -23.51 14.59 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 123.369 2.713 . . . . 0.0 112.599 -177.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -158.11 11.35 0.18 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.074 0.397 . . . . 0.0 111.574 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -71.27 148.05 43.5 Favored Glycine 0 CA--C 1.529 0.963 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.24 -24.76 16.46 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.523 2.815 . . . . 0.0 111.184 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.5 p90 -155.35 152.79 25.54 Favored Pre-proline 0 N--CA 1.454 -0.266 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 178.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -72.0 161.54 44.52 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.488 2.792 . . . . 0.0 111.297 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.89 142.38 50.67 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 102.545 -3.132 . . . . 0.0 102.545 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.256 0.7 OUTLIER -80.28 139.76 36.51 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.9 tt -84.47 152.17 24.14 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.414 1.085 . . . . 0.0 108.873 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.17 149.28 47.15 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 122.154 -0.341 . . . . 0.0 110.344 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.8 pp -153.95 162.63 41.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.106 0.479 . . . . 0.0 111.255 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 15.1 p -166.64 172.1 10.97 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.825 0.85 . . . . 0.0 110.75 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -56.14 127.23 29.63 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 33.2 t -81.97 148.89 28.45 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.259 1.0 OUTLIER -110.99 10.44 22.18 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 169.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.59 167.44 18.52 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.115 0.966 . . . . 0.0 111.491 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -93.99 -3.22 51.86 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -171.37 177.98 3.38 Favored 'General case' 0 C--N 1.338 0.101 0 C-N-CA 123.555 0.742 . . . . 0.0 110.16 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -134.92 21.33 3.51 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.812 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.242 -1.361 . . . . 0.0 110.599 178.137 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.446 " O3'" ' HE2' ' A' ' 415' ' ' LYS . . . . . . . . 0 O4'--C4' 1.423 -2.504 1 O4'-C1'-N19 112.487 4.287 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C5'-C4'-C3' 110.21 -3.527 . 0.383 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.517 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.858 2 O4'-C1'-N19 113.02 4.82 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.717 1 C5'-C4'-C3' 108.485 -4.677 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.787 1 O4'-C1'-N19 113.728 5.528 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.532 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 0 C5'-C4'-C3' 109.98 -3.68 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.858 0 C5'-C4'-C3' 110.686 -3.209 . 0.066 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.017 0 C3'-C2'-C1' 104.496 3.328 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.793 0 O4'-C1'-N19 111.3 3.1 . 0.219 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.823 1 C5'-C4'-C3' 108.082 -4.945 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.276 55.1 m-85 . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -74.09 170.73 53.05 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 111.53 -0.628 . . . . 0.0 111.53 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -69.85 165.31 31.49 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 124.135 3.223 . . . . 0.0 111.005 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -154.85 158.9 40.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.94 165.11 23.85 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.074 0.55 . . . . 0.0 111.346 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -75.48 -7.28 53.72 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.9 t -157.65 147.95 15.81 Favored Pre-proline 0 CA--C 1.531 0.219 0 O-C-N 122.149 -0.345 . . . . 0.0 111.196 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.39 -13.81 22.22 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 124.028 3.152 . . . . 0.0 111.909 172.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.4 t -100.38 151.47 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.558 0.743 . . . . 0.0 112.785 -177.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -130.7 153.75 48.66 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.396 1.478 . . . . 0.0 108.32 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -137.9 128.59 26.79 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.108 0.413 . . . . 0.0 111.018 -175.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.86 153.57 27.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.525 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.0 m-85 -142.56 173.5 11.48 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.33 9.72 78.93 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.22 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.2 mt -77.29 28.27 0.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.463 0.705 . . . . 0.0 111.849 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.65 -27.65 68.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -173.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.481 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -77.83 149.96 34.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 121.288 0.566 . . . . 0.0 111.16 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 48.2 t -68.46 -14.24 62.87 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.309 0.643 . . . . 0.0 112.635 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.3 -17.32 63.72 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 46.5 mmm -85.75 148.2 25.97 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 118.53 0.604 . . . . 0.0 110.866 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -160.79 158.71 28.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.378 0.671 . . . . 0.0 109.259 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 99.5 m -54.3 -40.6 68.06 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 122.322 0.249 . . . . 0.0 110.809 -177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -69.69 -38.69 77.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -75.95 -46.0 32.08 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 53.5 t -69.26 -40.64 80.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -176.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.403 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 2.4 t80 -76.15 -31.25 58.47 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -170.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.3 p30 -76.97 -28.44 55.14 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.714 1.143 . . . . 0.0 110.227 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.1 t -58.24 -57.79 9.27 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.566 1.7 p90 -76.56 -4.92 45.39 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 118.175 2.658 . . . . 0.0 118.175 173.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 42.7 t -73.85 -35.01 64.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.764 -0.585 . . . . 0.0 111.24 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.92 -12.41 11.1 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -87.92 -8.99 54.99 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 117.21 2.3 . . . . 0.0 117.21 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 176.87 -148.71 9.12 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.434 0.561 . . . . 0.0 112.733 -176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -107.12 130.43 54.69 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.102 0.561 . . . . 0.0 110.49 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.403 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.1 m -114.11 165.57 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -177.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -129.06 -53.71 1.2 Allowed 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -152.11 165.38 34.94 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.195 0.907 . . . . 0.0 113.045 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.87 147.04 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 124.6 1.16 . . . . 0.0 109.085 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -152.26 116.23 4.89 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.125 0.57 . . . . 0.0 111.376 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -77.86 158.08 29.6 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 115.821 1.786 . . . . 0.0 115.821 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -114.8 120.95 41.77 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.842 0.457 . . . . 0.0 112.123 -176.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -79.31 -13.06 59.89 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.9 0.48 . . . . 0.0 111.475 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 96.0 p -82.34 1.44 37.06 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.251 0.62 . . . . 0.0 111.895 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.442 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.4 mmtm -139.81 157.15 70.3 Favored Pre-proline 0 C--N 1.34 0.153 0 C-N-CA 124.311 1.044 . . . . 0.0 109.306 -177.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -68.08 -16.91 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.97 2.446 . . . . 0.0 111.343 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.79 100.65 0.14 Allowed Glycine 0 C--N 1.337 0.635 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.58 158.86 34.72 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.531 0.733 . . . . 0.0 109.633 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -159.64 148.29 17.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.109 0.481 . . . . 0.0 112.078 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.4 mtp -94.34 154.53 17.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.14 0.976 . . . . 0.0 108.99 170.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -145.38 151.43 15.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -134.33 135.64 42.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 8.0 ptp -166.04 174.61 9.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.611 0.764 . . . . 0.0 110.138 -173.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.84 120.47 11.96 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -72.39 -33.39 67.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -168.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.76 -86.61 0.02 OUTLIER Glycine 0 C--N 1.335 0.495 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -71.59 -30.89 66.34 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.37 -36.4 20.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 119.259 -0.976 . . . . 0.0 112.403 -174.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -84.45 -28.3 6.95 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 C-N-CA 118.808 -1.157 . . . . 0.0 110.049 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.86 -46.7 67.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.79 175.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -39.03 89.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 122.246 -0.284 . . . . 0.0 110.941 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.43 91.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.795 -0.566 . . . . 0.0 110.29 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 59.9 mt -78.47 -8.77 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.283 0.633 . . . . 0.0 111.209 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 54.4 m -102.22 -18.22 15.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -127.48 -29.56 2.67 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -169.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 89.4 mt -134.67 -11.08 2.38 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.467 1.485 . . . . 0.0 114.368 -172.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.71 101.0 2.45 Favored 'General case' 0 C--O 1.205 -1.272 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -168.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.626 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 14.8 m-80 76.88 21.72 1.15 Allowed 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 123.333 2.788 . . . . 0.0 113.741 -161.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.07 162.23 17.7 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.258 58.0 m-85 -76.96 138.68 39.81 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -158.74 137.46 11.09 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.448 0.699 . . . . 0.0 109.484 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.1 m-85 57.23 25.34 10.93 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 117.266 2.321 . . . . 0.0 117.266 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.3 9.59 86.88 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 -177.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -135.81 -164.16 1.5 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.057 1.343 . . . . 0.0 108.52 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -129.06 146.65 50.97 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.108 -0.37 . . . . 0.0 111.281 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptm -118.96 75.14 1.01 Allowed 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.947 0.899 . . . . 0.0 109.442 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.626 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 8.4 m120 -53.0 125.23 16.53 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 116.272 -1.823 . . . . 0.0 112.192 -173.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.424 2.0 t -128.74 150.6 34.55 Favored 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 113.455 -3.298 . . . . 0.0 116.434 169.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.1 t -159.61 172.25 18.14 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.212 1.405 . . . . 0.0 107.807 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.5 p -72.3 147.28 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 18.9 t -82.51 156.65 23.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.42 ' HE3' ' C6 ' ' B' ' 2' ' ' ' C' . 17.3 ptpt -96.6 -12.4 24.01 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.001 0.121 . . . . 0.0 110.954 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -83.75 153.45 64.33 Favored Pre-proline 0 N--CA 1.454 -0.252 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.03 -34.52 2.18 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.335 2.69 . . . . 0.0 112.306 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.52 159.04 11.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.177 0.444 . . . . 0.0 111.695 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 87.7 mt -83.72 150.08 4.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 173.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 62.0 mtm -125.5 130.24 24.16 Favored Pre-proline 0 CA--C 1.53 0.178 0 O-C-N 122.312 -0.243 . . . . 0.0 111.213 173.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -77.7 165.36 26.95 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.933 3.089 . . . . 0.0 110.87 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 147.62 -108.73 0.44 Allowed Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 177.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -72.51 162.43 29.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 120.837 0.351 . . . . 0.0 110.278 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.9 p -161.27 177.04 10.57 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.914 0.486 . . . . 0.0 110.321 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -144.46 163.44 33.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.96 162.62 54.39 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 121.11 0.283 . . . . 0.0 113.077 -174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.88 171.27 10.86 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.017 0.927 . . . . 0.0 109.94 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -69.33 -26.89 64.93 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.293 -0.254 . . . . 0.0 111.061 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -120.17 11.7 11.67 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.34 -171.6 28.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.801 -0.52 . . . . 0.0 111.801 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 70.2 m -124.91 -7.91 7.23 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -177.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.2 t -127.07 138.95 53.3 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 85.3 p -85.31 9.1 16.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.874 0.87 . . . . 0.0 111.627 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -138.24 151.61 47.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.09 146.51 25.58 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.691 0.396 . . . . 0.0 110.1 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -112.25 139.98 47.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -126.0 4.59 7.24 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 45.7 t -65.81 -20.64 66.32 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.915 0.486 . . . . 0.0 111.499 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -113.86 1.48 14.78 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.51 . . . . 0.0 111.423 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 42.3 t -77.67 147.28 35.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.894 0.378 . . . . 0.0 111.334 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.21 -8.32 48.86 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.816 0.447 . . . . 0.0 110.926 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -61.88 -20.03 63.29 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 122.76 0.424 . . . . 0.0 112.052 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -58.74 115.36 3.02 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.235 0.614 . . . . 0.0 109.627 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -74.78 -33.43 62.26 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -172.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -95.25 16.04 17.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.3 p -70.99 -10.9 60.55 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.4 149.94 67.08 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.94 -25.32 59.7 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.989 2.459 . . . . 0.0 111.614 176.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -75.49 -28.31 59.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.363 0.265 . . . . 0.0 110.698 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -81.97 -46.11 14.45 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.96 -16.97 61.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -174.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -78.19 -19.77 53.23 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.443 0.297 . . . . 0.0 111.785 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.04 -2.93 8.13 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.12 159.64 22.96 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.498 0.59 . . . . 0.0 110.317 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -151.79 145.94 25.35 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.3 mm -140.53 139.83 34.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 123.747 0.819 . . . . 0.0 109.356 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -150.11 166.38 29.96 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.179 0.991 . . . . 0.0 109.661 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.51 138.84 97.48 Favored Pre-proline 0 C--O 1.233 0.203 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.36 151.07 81.91 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.463 2.775 . . . . 0.0 111.339 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 83.1 p -148.42 -173.73 4.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.303 -175.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -83.74 4.72 27.61 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.813 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.15 137.97 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 73.3 mt -124.5 155.58 38.72 Favored 'General case' 0 N--CA 1.458 -0.057 0 C-N-CA 122.989 0.515 . . . . 0.0 109.782 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -121.75 144.44 48.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.352 1.061 . . . . 0.0 108.265 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -136.65 159.25 42.38 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.457 0.646 . . . . 0.0 110.688 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -152.27 168.45 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 103.722 -2.695 . . . . 0.0 103.722 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 57.61 57.49 4.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.678 0.391 . . . . 0.0 111.486 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -142.23 119.46 7.25 Favored Pre-proline 0 CA--C 1.534 0.334 0 O-C-N 122.392 -0.193 . . . . 0.0 111.176 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -53.04 161.75 3.18 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 124.417 3.411 . . . . 0.0 113.219 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.52 -16.41 63.87 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.275 0.63 . . . . 0.0 111.914 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -94.07 -1.99 53.54 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.5 m -78.93 -11.5 13.15 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.655 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.9 m -55.25 179.07 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.226 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -168.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.655 ' H ' HG22 ' A' ' 510' ' ' THR . 89.0 tt0 12.09 -68.8 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.851 2.061 . . . . 0.0 114.189 175.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 510' ' ' THR . 95.8 mt-10 -54.36 -48.14 71.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -88.0 -23.57 23.77 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 121.941 2.155 . . . . 0.0 106.014 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -62.13 -40.8 97.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 118.259 -1.376 . . . . 0.0 113.468 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -72.61 -44.07 62.46 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -77.38 -18.9 56.93 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.491 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.5 mt -75.51 -39.16 40.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.116 0 CA-C-N 118.486 0.585 . . . . 0.0 109.509 173.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.8 -38.69 89.64 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.769 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -68.7 -29.36 67.78 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -75.08 -26.52 59.39 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.392 0.277 . . . . 0.0 110.775 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.72 -2.16 44.99 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 111.326 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.86 -0.7 61.22 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 123.295 0.474 . . . . 0.0 113.104 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.0 151.16 5.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.893 0.847 . . . . 0.0 112.206 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.42 149.84 49.72 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.937 0.398 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.94 152.92 91.02 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 123.112 0.565 . . . . 0.0 111.226 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.57 157.59 60.21 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.631 2.887 . . . . 0.0 110.529 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -89.22 -17.14 29.66 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.7 t -155.21 159.13 39.87 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.613 0.244 . . . . 0.0 111.421 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 62.6 t -143.13 144.93 23.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 C-N-CA 124.449 1.1 . . . . 0.0 110.09 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -148.18 140.97 24.66 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.18 143.74 29.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -154.89 -171.77 3.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.8 t -141.44 -172.15 3.46 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.765 0.826 . . . . 0.0 109.91 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 100.46 11.22 42.19 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 123.526 0.584 . . . . 0.0 112.373 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -126.95 -17.32 4.91 Favored 'General case' 0 C--N 1.339 0.148 0 CA-C-N 117.762 0.781 . . . . 0.0 112.593 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -163.56 152.96 14.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 117.876 0.307 . . . . 0.0 110.774 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.93 -8.09 31.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.921 0.489 . . . . 0.0 110.63 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -79.38 -41.85 26.86 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.254 0.622 . . . . 0.0 111.684 -178.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.5 p -164.05 173.59 12.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 110.814 -173.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 45.5 p -83.44 177.74 8.33 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.547 0.689 . . . . 0.0 111.066 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.6 p -150.57 163.06 39.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.75 -169.67 42.65 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.197 -1.002 . . . . 0.0 112.827 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.33 160.28 23.34 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.448 0.699 . . . . 0.0 110.479 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.9 mt -139.27 157.96 44.99 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.858 1.263 . . . . 0.0 108.091 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -148.12 149.23 31.65 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.093 0.406 . . . . 0.0 111.995 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -127.12 175.06 8.41 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.351 1.461 . . . . 0.0 112.39 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -76.52 -12.3 60.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.609 0.364 . . . . 0.0 110.999 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.5 t -158.32 160.52 37.08 Favored 'General case' 0 C--O 1.232 0.163 0 O-C-N 121.808 -0.557 . . . . 0.0 110.851 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -75.15 -21.54 58.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.02 -0.425 . . . . 0.0 110.935 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.4 m -77.25 -25.67 51.73 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.019 0.372 . . . . 0.0 110.065 174.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -74.72 -34.05 62.51 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.245 0.618 . . . . 0.0 111.896 173.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.35 -28.96 57.03 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.386 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.5 tp -72.74 -39.25 67.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.734 0.243 . . . . 0.0 111.284 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -73.39 -39.03 65.41 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -26.27 62.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 176.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . 0.421 HD13 ' C ' ' A' ' 556' ' ' LEU . 1.6 tm? -68.11 -37.73 81.49 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 172.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.94 -30.05 75.51 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.559 -0.578 . . . . 0.0 112.325 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 7.5 m-85 -98.69 -8.25 26.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 118.924 2.935 . . . . 0.0 118.924 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.36 -8.69 10.51 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -72.05 145.36 48.31 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.354 0.979 . . . . 0.0 108.923 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.64 21.84 9.2 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.571 0.748 . . . . 0.0 112.326 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -61.54 134.24 56.62 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -81.11 121.21 25.82 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.047 -0.408 . . . . 0.0 110.732 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.8 152.61 18.33 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -67.27 162.36 22.9 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 169.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -151.09 121.34 3.68 Favored Pre-proline 0 CA--C 1.531 0.25 0 O-C-N 122.342 -0.224 . . . . 0.0 110.639 -178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -79.77 -16.05 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.284 2.656 . . . . 0.0 111.886 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -82.87 -12.45 57.39 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 173.11 173.76 39.72 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -71.6 -19.59 27.91 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.904 3.07 . . . . 0.0 111.5 -177.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -78.65 130.54 70.57 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.51 168.85 14.28 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.689 2.926 . . . . 0.0 111.486 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -129.82 142.37 50.69 Favored 'General case' 0 N--CA 1.457 -0.109 0 N-CA-C 103.049 -2.945 . . . . 0.0 103.049 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.251 1.0 OUTLIER -81.67 131.3 35.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -178.053 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -78.5 149.29 33.17 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.03 147.25 46.09 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.566 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.92 159.84 38.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.647 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 20.4 p -160.81 174.74 13.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.024 0.929 . . . . 0.0 110.144 -177.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -58.09 124.45 19.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.438 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 29.3 t -79.76 149.52 31.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -171.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.266 0.8 OUTLIER -111.38 9.97 21.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 169.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.82 164.42 19.66 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.231 1.012 . . . . 0.0 111.863 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -92.83 -3.07 55.3 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.709 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -170.6 177.0 4.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.746 0.818 . . . . 0.0 110.074 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.41 28.33 1.2 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.072 0.549 . . . . 0.0 111.64 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 117.426 -1.273 . . . . 0.0 111.154 -177.797 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.525 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.683 1 O4'-C1'-N19 112.487 4.287 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.42 ' C6 ' ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C5'-C4'-C3' 110.767 -3.155 . 0.447 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.768 1 C3'-C2'-C1' 105.378 4.309 . 0.126 0b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 1 C5'-C4'-C3' 108.957 -4.362 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.814 1 O4'-C1'-N19 113.185 4.985 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.456 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.748 0 C3'-C2'-C1' 104.625 3.473 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.778 0 O4'-C1'-N19 111.235 3.035 . 0.077 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.939 0 C3'-C2'-C1' 104.871 3.745 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.438 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.92 0 O4'-C1'-N19 111.066 2.866 . 0.177 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 1 C5'-C4'-C3' 108.315 -4.79 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.26 7.8 p90 . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -75.63 -176.6 40.02 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 111.959 -0.456 . . . . 0.0 111.959 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.4 170.09 1.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.774 3.65 . . . . 0.0 112.821 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -148.59 152.3 36.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.915 0.486 . . . . 0.0 110.728 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.72 26.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.066 0.547 . . . . 0.0 110.882 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -82.81 -0.93 50.23 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.1 t -156.96 144.77 14.08 Favored Pre-proline 0 C--O 1.232 0.151 0 C-N-CA 122.804 0.442 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.7 -15.29 33.56 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.209 2.606 . . . . 0.0 110.836 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.01 150.91 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.1 153.03 42.49 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.933 0.893 . . . . 0.0 109.707 -175.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . 0.432 ' O ' HG13 ' A' ' 448' ' ' VAL . 97.0 mmm -120.32 147.59 44.82 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 123.55 0.74 . . . . 0.0 111.39 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 5.9 p -139.65 146.2 25.67 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.437 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 10.5 m-85 -143.21 173.71 11.35 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -177.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.56 61.75 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.673 -0.571 . . . . 0.0 111.673 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 20.7 mt -75.73 32.32 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.881 0.872 . . . . 0.0 111.481 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -71.08 14.29 0.16 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -174.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -137.12 149.57 47.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.126 0.571 . . . . 0.0 110.811 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 39.3 t -69.53 -13.63 62.43 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.495 0.718 . . . . 0.0 112.057 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -67.77 -20.61 65.24 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 122.676 0.39 . . . . 0.0 111.875 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 67.4 mtp -94.28 148.57 22.08 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 122.069 -0.394 . . . . 0.0 110.615 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.78 154.39 28.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.3 p -59.17 -30.69 68.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -176.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -70.09 -43.23 71.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -76.03 -42.1 48.84 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 41.4 t -69.32 -42.31 81.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 -176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -76.29 -29.99 57.59 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.805 -0.616 . . . . 0.0 111.19 -171.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -75.95 -31.04 58.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.344 0.975 . . . . 0.0 109.857 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.97 -55.63 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.55 1.8 p90 -76.59 -4.86 45.12 Favored 'General case' 0 C--N 1.339 0.147 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.8 t -72.39 -34.31 67.82 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 122.008 -0.432 . . . . 0.0 110.867 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.52 -14.46 19.88 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.096 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.33 -3.48 58.46 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.6 -174.83 43.29 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 119.193 0.906 . . . . 0.0 113.262 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -76.34 130.12 37.62 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -129.93 -61.3 1.0 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 176.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -148.39 165.13 32.02 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -170.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -144.37 145.01 21.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 124.774 1.23 . . . . 0.0 108.485 171.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -153.7 121.49 5.98 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -76.98 166.93 22.66 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.8 ptp -142.82 138.0 30.04 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 118.879 0.763 . . . . 0.0 112.714 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -5.56 53.98 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.706 1.202 . . . . 0.0 112.156 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 43.0 t -78.06 -4.97 49.9 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.214 0.605 . . . . 0.0 111.646 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.49 155.57 67.15 Favored Pre-proline 0 CA--C 1.53 0.184 0 C-N-CA 123.993 0.917 . . . . 0.0 109.918 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 -13.75 38.14 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.392 2.728 . . . . 0.0 111.894 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.43 87.27 0.07 OUTLIER Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -152.48 160.44 43.25 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.963 0.505 . . . . 0.0 110.838 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.61 170.43 22.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.663 0.385 . . . . 0.0 110.434 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 22.1 mtm -123.97 157.34 34.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.034 0.934 . . . . 0.0 108.828 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 15.3 t -142.0 152.03 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.756 0.822 . . . . 0.0 110.38 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.73 132.87 42.78 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtp -155.13 172.39 18.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -171.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.08 127.05 30.6 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 170.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -73.07 -34.76 66.43 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -168.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.11 -89.1 0.01 OUTLIER Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -72.78 -26.54 61.57 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.7 -36.43 17.4 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 118.838 -1.145 . . . . 0.0 111.668 -174.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.79 -27.31 6.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.205 0 C-N-CA 118.553 -1.259 . . . . 0.0 109.374 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -68.77 -53.39 22.05 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.108 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 25.6 mtm180 -68.9 -29.99 68.39 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.05 78.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.094 -0.643 . . . . 0.0 110.011 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.4 mt -79.72 -9.97 12.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.303 0.641 . . . . 0.0 111.084 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 29.9 m -96.77 -21.33 17.61 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -125.79 -26.9 3.41 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -169.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 88.1 mt -134.59 -8.75 2.48 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.906 1.684 . . . . 0.0 114.624 -172.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.637 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.2 p-10 -71.63 101.09 2.43 Favored 'General case' 0 C--O 1.207 -1.157 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -168.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.573 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 16.3 m-80 77.47 22.02 0.97 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 123.98 3.082 . . . . 0.0 114.054 -160.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -76.87 163.06 27.12 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.906 -1.121 . . . . 0.0 110.207 168.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -68.71 136.61 53.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 173.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.9 ttt -158.43 142.26 15.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 554' ' ' GLU 0.273 53.2 m-85 59.92 15.63 5.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.16 9.17 70.74 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -136.03 -171.14 2.8 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.497 1.119 . . . . 0.0 108.439 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -128.43 136.2 50.54 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.088 -0.383 . . . . 0.0 110.795 178.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -94.82 -152.51 0.36 Allowed 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 31.4 t-20 -159.22 129.28 5.69 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 115.903 -1.999 . . . . 0.0 110.521 175.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.637 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.459 2.1 t -124.03 145.25 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 112.864 -3.534 . . . . 0.0 115.147 167.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -161.29 164.76 29.99 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.869 0.868 . . . . 0.0 109.442 -176.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.4 p -75.29 150.69 6.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 37.0 t -93.29 158.09 15.92 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.726 0.81 . . . . 0.0 111.997 -178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -96.85 -7.88 32.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.667 0.387 . . . . 0.0 110.552 175.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -71.01 147.52 93.9 Favored Pre-proline 0 CA--C 1.529 0.164 0 C-N-CA 123.494 0.717 . . . . 0.0 110.526 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.9 -32.91 2.39 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.195 2.597 . . . . 0.0 111.435 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.77 158.87 9.34 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.544 0.738 . . . . 0.0 110.395 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 67.5 mt -82.89 133.42 29.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 34.2 mmm -98.0 129.32 31.3 Favored Pre-proline 0 N--CA 1.454 -0.274 0 C-N-CA 122.374 0.27 . . . . 0.0 111.241 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.32 161.95 37.04 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.437 2.758 . . . . 0.0 109.024 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 151.76 -129.52 2.85 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 121.128 -0.558 . . . . 0.0 111.899 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -72.32 171.3 12.43 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.267 0.627 . . . . 0.0 111.149 -177.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.6 p -156.01 170.13 22.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.538 0.735 . . . . 0.0 109.403 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -128.75 5.88 5.55 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.39 -170.95 55.16 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.215 -0.303 . . . . 0.0 112.499 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.3 mt -143.01 168.35 19.91 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.081 0.952 . . . . 0.0 109.592 -178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -75.22 -24.34 57.71 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 122.364 -0.21 . . . . 0.0 110.45 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -120.61 20.27 11.8 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.618 0.767 . . . . 0.0 110.825 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.33 167.32 36.86 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.604 -0.685 . . . . 0.0 112.289 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 t -93.66 -26.67 16.95 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.73 0.412 . . . . 0.0 112.111 -176.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.7 t -127.02 148.03 50.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.986 0.515 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.4 p -90.17 7.94 35.48 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.394 0.678 . . . . 0.0 111.418 178.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -134.34 145.82 49.37 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -156.57 151.73 26.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.888 0.375 . . . . 0.0 110.663 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.1 130.32 41.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.587 0.755 . . . . 0.0 112.25 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -89.54 -12.03 41.12 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 117.542 2.423 . . . . 0.0 117.542 -173.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 43.9 t -68.93 -29.93 68.27 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.641 0.257 . . . . 0.0 110.357 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -80.0 -18.38 50.4 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 122.699 0.399 . . . . 0.0 111.117 177.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.2 m -93.87 -4.0 50.78 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.873 0.469 . . . . 0.0 112.056 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 478' ' ' ARG . 0.1 OUTLIER 61.66 3.96 0.96 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.311 1.044 . . . . 0.0 112.83 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -59.61 -17.64 34.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -57.05 122.27 11.95 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.247 0.619 . . . . 0.0 110.625 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -81.05 -33.66 33.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.304 64.7 m-85 -98.0 10.46 40.29 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 117.376 2.362 . . . . 0.0 117.376 -178.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 86.5 p -71.79 -10.72 60.19 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -135.96 148.98 67.19 Favored Pre-proline 0 C--O 1.232 0.136 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 179.623 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.4 Cg_exo -64.47 -24.63 63.64 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 123.237 2.625 . . . . 0.0 111.554 176.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -73.97 -27.5 61.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.344 0.257 . . . . 0.0 110.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -88.44 -43.17 11.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 175.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.39 63.79 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.48 -18.61 44.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -124.06 -4.9 7.94 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -62.93 158.97 17.85 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 118.105 0.411 . . . . 0.0 110.752 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.405 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 13.0 ptp180 -150.03 144.91 26.09 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.5 mm -136.29 153.03 30.69 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 C-N-CA 123.891 0.876 . . . . 0.0 108.724 -175.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -155.01 162.26 41.13 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -57.28 153.01 28.54 Favored Pre-proline 0 CA--C 1.531 0.225 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -63.81 143.41 86.06 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.923 2.416 . . . . 0.0 109.644 -177.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.4 t -153.63 171.93 18.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.774 0.43 . . . . 0.0 110.205 -173.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -83.73 2.31 38.48 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.265 -0.272 . . . . 0.0 110.877 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.39 137.81 24.82 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 71.0 mt -125.39 156.09 39.34 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.081 0.553 . . . . 0.0 109.691 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -125.09 132.79 53.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -120.96 160.59 23.21 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 111.505 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -147.79 153.6 39.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 28.0 m120 55.52 57.47 5.32 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.072 -175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -113.6 153.06 45.9 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 122.897 0.479 . . . . 0.0 110.205 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -57.7 153.63 41.84 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.493 2.795 . . . . 0.0 112.696 -177.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.65 -16.3 63.79 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.381 0.672 . . . . 0.0 112.059 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -122.95 25.0 8.77 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.484 0.714 . . . . 0.0 110.95 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.61 -9.35 10.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 N-CA-C 115.17 1.544 . . . . 0.0 115.17 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 512' ' ' GLU . 0.2 OUTLIER -54.88 -177.29 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 117.214 -1.374 . . . . 0.0 114.222 -165.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.506 ' H ' HG22 ' A' ' 510' ' ' THR . 8.8 pm0 -30.86 -33.55 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.397 1.453 . . . . 0.0 114.77 -167.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.0 mt-10 -60.3 -45.64 92.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 117.047 -1.454 . . . . 0.0 114.723 170.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -87.53 -30.03 20.89 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 122.745 2.52 . . . . 0.0 106.528 -173.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -62.44 -33.81 75.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -76.15 -42.71 45.8 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -79.84 -19.27 48.77 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.659 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.2 -44.87 42.75 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 118.698 0.681 . . . . 0.0 110.081 175.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.6 m -64.19 -33.93 76.91 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.902 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -67.28 -37.39 83.35 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.013 0.435 . . . . 0.0 112.01 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -74.46 -30.71 61.98 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.707 0.403 . . . . 0.0 111.124 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.35 -4.61 58.99 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.649 0.379 . . . . 0.0 111.926 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 71.95 33.6 62.58 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.62 159.63 42.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.57 0.748 . . . . 0.0 112.889 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.08 149.09 50.83 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.138 0.575 . . . . 0.0 111.736 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -91.13 157.13 43.33 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 123.572 0.749 . . . . 0.0 111.023 -178.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -68.23 160.83 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.575 2.85 . . . . 0.0 111.196 174.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -97.87 -18.6 18.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 38.1 m -148.49 156.34 42.33 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.671 . . . . 0.0 110.959 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 59.7 t -143.98 148.22 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.543 0.737 . . . . 0.0 110.863 -175.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -147.35 142.36 27.02 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 123.804 0.842 . . . . 0.0 108.884 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -140.51 142.82 30.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 122.99 0.516 . . . . 0.0 112.282 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -156.09 -175.61 5.52 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -178.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.2 p -142.71 -169.09 2.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.465 1.106 . . . . 0.0 109.336 178.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.43 8.85 62.25 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.739 -0.478 . . . . 0.0 112.698 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.02 9.62 2.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 117.699 0.749 . . . . 0.0 111.371 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 42.5 t -158.63 157.62 32.24 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.765 0.826 . . . . 0.0 109.543 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -116.96 -5.34 11.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.996 0.518 . . . . 0.0 111.037 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -89.91 -50.17 6.19 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 122.843 0.457 . . . . 0.0 112.205 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 80.6 p -165.53 179.0 6.35 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 122.77 0.428 . . . . 0.0 110.94 -177.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 74.3 m -70.22 168.95 14.69 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.8 t -147.07 163.96 34.58 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.58 1.552 . . . . 0.0 108.398 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.12 -171.92 44.92 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.56 -0.829 . . . . 0.0 113.126 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.82 160.31 22.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.8 0.84 . . . . 0.0 110.484 -177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.3 mt -140.66 158.16 44.38 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.647 1.179 . . . . 0.0 108.936 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -148.72 152.21 36.23 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 117.607 0.185 . . . . 0.0 111.228 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 17.4 m-90 -128.42 167.84 16.45 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.869 1.268 . . . . 0.0 112.785 -177.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -70.53 -8.32 50.42 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -158.44 161.22 37.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.51 0.324 . . . . 0.0 110.932 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -66.13 -34.83 78.94 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.906 0.482 . . . . 0.0 110.219 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.9 p -78.35 -25.82 46.51 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.425 0.29 . . . . 0.0 110.893 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -68.79 -35.34 76.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.39 65.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 48.0 tp -65.51 -40.06 92.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.613 0.244 . . . . 0.0 110.585 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . 0.484 ' HG3' ' CE1' ' A' ' 442' ' ' PHE . 39.8 tt0 -64.27 -47.93 77.67 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.479 0.657 . . . . 0.0 110.712 177.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.86 -19.2 61.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 4.0 tt -66.62 -44.29 82.42 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 173.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.9 -45.69 96.03 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.284 19.0 m-85 -76.86 -32.02 57.22 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 119.103 3.001 . . . . 0.0 119.103 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 57.8 mt -90.73 -19.29 23.71 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 119.504 1.047 . . . . 0.0 112.933 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -73.99 145.34 44.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.131 0.878 . . . . 0.0 110.118 -178.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 57.54 12.62 1.58 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.431 1.093 . . . . 0.0 113.091 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 40.1 t80 -72.9 138.83 46.45 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -71.73 132.83 45.08 Favored 'General case' 0 N--CA 1.457 -0.114 0 O-C-N 122.212 -0.305 . . . . 0.0 111.706 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.1 mtm -83.73 152.56 24.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.59 0.356 . . . . 0.0 110.96 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.22 146.84 45.19 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -155.85 78.02 4.49 Favored Pre-proline 0 N--CA 1.454 -0.244 0 O-C-N 122.165 -0.335 . . . . 0.0 110.669 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -71.0 -8.6 23.97 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.214 2.609 . . . . 0.0 111.029 176.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -93.83 5.82 50.41 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.407 0.683 . . . . 0.0 112.366 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -154.31 168.05 32.51 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-N 118.316 0.507 . . . . 0.0 112.033 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.03 -18.03 21.7 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 124.26 3.307 . . . . 0.0 112.48 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -150.57 151.03 30.0 Favored Pre-proline 0 N--CA 1.455 -0.202 0 N-CA-C 116.232 1.938 . . . . 0.0 116.232 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.77 164.46 33.56 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.806 3.004 . . . . 0.0 111.746 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -129.98 142.35 50.64 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 103.047 -2.945 . . . . 0.0 103.047 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -76.65 142.21 40.7 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.864 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.1 tt -83.88 150.32 25.79 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.196 0.998 . . . . 0.0 108.457 173.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -134.0 151.38 51.42 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 118.475 0.58 . . . . 0.0 111.147 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.4 pp -159.46 167.69 28.07 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.104 0.478 . . . . 0.0 111.43 177.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 12.5 p -162.6 174.05 13.13 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.293 1.037 . . . . 0.0 110.409 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -57.36 121.38 10.05 Favored 'General case' 0 C--N 1.34 0.156 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.432 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 38.9 t -77.83 149.15 34.41 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 0.6 OUTLIER -110.98 9.93 22.19 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 114.7 1.371 . . . . 0.0 114.7 169.545 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.22 166.57 16.06 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.161 0.984 . . . . 0.0 111.84 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 56.8 mm-40 -93.32 -3.03 54.21 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.84 177.97 3.64 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.575 0.75 . . . . 0.0 110.04 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -144.62 31.8 1.18 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.762 0.425 . . . . 0.0 111.607 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.89 -178.864 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.437 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.7 1 O4'-C1'-N19 112.453 4.253 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 O4'-C1'-N19 111.506 3.306 . 0.414 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.982 0 C3'-C2'-C1' 105.087 3.985 . 0.132 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.706 1 C5'-C4'-C3' 109.182 -4.212 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 1 O4'-C1'-N19 113.784 5.584 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.493 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C5'-C4'-C3' 110.024 -3.651 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.857 0 C5'-C4'-C3' 111.22 -2.853 . 0.075 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.957 0 C3'-C2'-C1' 104.647 3.496 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.432 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.888 0 O4'-C1'-N19 111.271 3.071 . 0.223 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.929 1 C5'-C4'-C3' 107.651 -5.233 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.256 54.1 m-85 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 115.108 1.522 . . . . 0.0 115.108 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -72.82 176.57 42.91 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.38 174.85 9.44 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.274 3.316 . . . . 0.0 110.719 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -147.89 154.59 40.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 120.868 0.366 . . . . 0.0 110.815 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.43 161.14 30.1 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.151 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -75.44 -5.71 46.42 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.2 t -158.71 146.7 13.68 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 122.895 0.478 . . . . 0.0 110.553 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.21 -16.79 40.12 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.288 2.659 . . . . 0.0 110.519 174.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.57 148.77 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.7 tt -137.6 152.0 48.93 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.771 1.229 . . . . 0.0 107.966 -178.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.1 tpt -134.59 130.11 35.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.397 0.142 . . . . 0.0 110.779 -172.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.68 152.85 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.538 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.8 m-85 -139.91 172.16 13.17 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 104.624 -2.361 . . . . 0.0 104.624 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.84 9.42 77.8 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 120.141 -0.255 . . . . 0.0 112.653 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.8 mt -79.02 27.89 0.23 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.553 0.676 . . . . 0.0 112.244 -179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.81 -41.46 95.77 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.452 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.0 pm0 -67.04 146.22 54.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.051 0.453 . . . . 0.0 111.016 -178.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 56.6 m -68.68 -10.12 54.34 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -173.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -73.17 -19.62 61.08 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 117.939 0.336 . . . . 0.0 111.612 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 86.8 mmm -82.32 146.65 29.29 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.157 0.435 . . . . 0.0 110.587 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -160.92 155.74 23.89 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -59.13 -36.79 75.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -176.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -68.23 -39.33 82.37 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -75.93 -47.51 24.9 Favored 'General case' 0 C--N 1.34 0.153 0 O-C-N 122.192 -0.318 . . . . 0.0 111.651 -173.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.38 -37.74 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.8 -31.84 57.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -75.94 -29.9 58.51 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.703 1.138 . . . . 0.0 110.296 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -60.13 -55.8 21.74 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 2.5 p90 -76.57 -3.93 40.18 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 117.505 2.409 . . . . 0.0 117.505 174.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 40.6 t -74.95 -35.0 62.14 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.059 -0.401 . . . . 0.0 110.803 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.09 -15.83 26.66 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.13 -7.39 59.64 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 117.295 2.331 . . . . 0.0 117.295 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.64 -143.21 6.99 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 -176.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -113.77 132.94 55.66 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.801 0.44 . . . . 0.0 110.773 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.5 8.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -117.63 -67.42 0.99 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -154.45 170.51 21.21 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.73 148.48 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.066 0 C-N-CA 123.845 0.858 . . . . 0.0 109.42 -177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -152.31 108.52 3.4 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 122.576 0.351 . . . . 0.0 111.415 -174.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -73.24 163.88 27.48 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 24.0 ptp -142.18 142.03 32.66 Favored 'General case' 0 C--N 1.339 0.129 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -5.57 54.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.742 1.617 . . . . 0.0 112.987 177.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.6 t -77.87 -8.18 57.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.109 0.563 . . . . 0.0 112.238 -172.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.42 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 45.2 mmtm -141.03 157.52 66.89 Favored Pre-proline 0 CA--C 1.528 0.12 0 C-N-CA 123.644 0.777 . . . . 0.0 109.598 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -67.54 -12.23 34.92 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.181 2.588 . . . . 0.0 111.496 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.05 95.4 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.56 160.41 38.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.208 0.603 . . . . 0.0 110.05 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.03 153.95 23.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.22 0.533 . . . . 0.0 111.732 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 83.3 mtp -96.97 153.29 17.99 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.948 0.899 . . . . 0.0 108.985 172.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.8 t -145.51 153.83 13.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -139.07 134.29 32.75 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 30.3 mtp -151.86 173.31 14.94 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 123.757 0.823 . . . . 0.0 109.388 -170.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.31 125.07 23.92 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 169.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.93 -33.1 65.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -167.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.17 -89.33 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -73.74 -23.69 59.79 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.97 -32.56 15.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 118.737 -1.185 . . . . 0.0 112.107 -175.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.2 -25.06 6.21 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 120.179 1.354 . . . . 0.0 109.082 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -68.53 -50.15 54.2 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 118.056 0.389 . . . . 0.0 111.302 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.64 -37.0 85.32 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.35 80.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.732 0.697 . . . . 0.0 110.674 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.2 mt -77.72 -12.76 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 123.028 0.531 . . . . 0.0 110.81 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.8 m -96.8 -18.96 19.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.449 ' C ' HD22 ' A' ' 436' ' ' LEU . 92.9 m-70 -129.5 -25.76 2.6 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 116.161 1.912 . . . . 0.0 116.161 -169.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.9 mm? -129.52 -14.32 4.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.144 1.338 . . . . 0.0 113.473 -172.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.662 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.94 100.91 2.55 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -168.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.1 m-80 76.69 21.27 1.28 Allowed 'General case' 0 N--CA 1.481 1.088 0 O-C-N 117.916 -2.99 . . . . 0.0 112.264 -162.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -84.03 157.45 21.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -77.51 139.37 39.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.6 ttt -159.12 138.61 11.55 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.022 0.529 . . . . 0.0 109.597 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.399 49.8 m-85 56.92 25.79 10.95 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 -178.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 77.95 10.33 86.3 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 111.501 -0.639 . . . . 0.0 111.501 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.9 mm-40 -134.83 -167.3 1.96 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.861 1.264 . . . . 0.0 108.913 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -132.29 147.81 52.42 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.285 0.234 . . . . 0.0 111.031 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 18.7 ptt? -125.36 87.23 2.67 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 176.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.618 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.0 m120 -55.45 128.35 33.92 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 115.634 -2.127 . . . . 0.0 111.907 -174.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.662 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.423 2.4 t -126.82 154.15 36.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 113.28 -3.368 . . . . 0.0 116.059 169.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 37.9 t -162.09 167.42 24.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.568 1.547 . . . . 0.0 107.757 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.93 147.91 10.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 26.2 t -79.44 165.18 23.33 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 122.52 0.328 . . . . 0.0 110.5 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.4 31.56 6.27 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.412 ' HB2' ' HD2' ' A' ' 454' ' ' PRO . 12.0 pt20 -137.12 160.91 64.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' A' ' 453' ' ' GLN . 83.3 Cg_endo -75.0 -37.1 2.18 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.986 2.457 . . . . 0.0 116.198 -167.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -166.01 154.5 11.06 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.946 1.248 . . . . 0.0 112.889 -176.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 66.0 mt -77.05 150.83 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 173.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 54.9 mtm -129.27 136.79 29.7 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 117.584 0.175 . . . . 0.0 111.319 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.78 168.75 23.65 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.085 3.19 . . . . 0.0 110.564 177.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 143.37 -115.04 0.88 Allowed Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -72.43 153.55 41.35 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.1 0.56 . . . . 0.0 110.454 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 46.9 m -152.96 172.56 16.62 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.135 0.974 . . . . 0.0 110.03 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -144.58 164.07 32.01 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -83.38 132.08 10.83 Favored Glycine 0 CA--C 1.526 0.744 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.22 163.37 26.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 174.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.69 -18.52 64.95 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -120.55 23.11 10.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.102 0.561 . . . . 0.0 109.931 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.97 -162.31 15.75 Favored Glycine 0 CA--C 1.525 0.7 0 O-C-N 121.691 -0.631 . . . . 0.0 112.351 -176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 98.2 p -133.1 -10.74 2.95 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 122.727 0.411 . . . . 0.0 112.001 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.1 t -127.09 155.9 42.55 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.912 0.485 . . . . 0.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 80.2 p -115.72 8.96 15.07 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.446 0.698 . . . . 0.0 111.794 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -135.5 146.29 47.96 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -155.37 157.65 37.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.468 0.175 . . . . 0.0 110.64 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -128.77 139.35 52.24 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -173.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -133.78 5.07 3.63 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 31.9 t -65.39 -22.69 66.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.266 0.627 . . . . 0.0 111.825 -174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -113.89 1.48 14.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.156 0.582 . . . . 0.0 111.479 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -79.66 153.33 29.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.526 0.33 . . . . 0.0 111.365 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -85.42 -7.51 58.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.509 0.324 . . . . 0.0 111.283 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . 0.456 HD21 ' CD2' ' A' ' 561' ' ' HIS . 5.6 m-20 -60.13 -20.74 59.81 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -60.5 127.61 32.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -70.11 -33.76 72.25 Favored 'General case' 0 N--CA 1.458 -0.066 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -170.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.363 55.8 m-85 -98.14 17.53 18.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.5 t -60.0 -28.57 67.83 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -172.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.56 155.32 75.37 Favored Pre-proline 0 C--N 1.339 0.129 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -178.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.27 -25.37 76.64 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.306 2.671 . . . . 0.0 112.066 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -74.65 -29.75 61.37 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -80.43 -45.42 17.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.78 66.12 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.6 -25.0 56.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.936 0.335 . . . . 0.0 111.609 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -124.02 3.84 8.67 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -61.19 154.7 22.64 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.425 0.557 . . . . 0.0 111.679 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -154.63 141.87 19.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 36.0 mm -137.22 148.66 26.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.648 0.779 . . . . 0.0 109.337 -174.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -148.52 170.03 18.96 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.512 0.725 . . . . 0.0 110.59 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -64.43 157.09 74.13 Favored Pre-proline 0 N--CA 1.453 -0.295 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.71 148.32 90.16 Favored 'Trans proline' 0 N--CA 1.448 -1.197 0 C-N-CA 122.524 2.15 . . . . 0.0 109.808 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.9 t -153.95 173.66 15.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.815 0.446 . . . . 0.0 109.839 -173.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -83.74 -3.18 57.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.279 -0.263 . . . . 0.0 110.732 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -96.95 138.22 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 176.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 65.6 mt -125.5 156.52 38.85 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.19 0.596 . . . . 0.0 109.862 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -124.53 143.42 50.68 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -132.96 160.13 37.98 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.977 0.418 . . . . 0.0 111.452 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -144.16 150.96 38.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 51.83 57.42 6.54 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.304 1.042 . . . . 0.0 112.587 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -104.14 156.33 35.89 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.512 0.725 . . . . 0.0 110.302 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.83 153.04 32.65 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.317 2.678 . . . . 0.0 112.742 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.67 -16.34 63.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.442 0.697 . . . . 0.0 112.047 -176.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -122.92 20.99 9.97 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.523 0.729 . . . . 0.0 110.949 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.6 p -64.74 -16.12 19.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.677 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.47 -177.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -165.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.677 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -22.72 -41.04 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -170.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.2 mt-10 -58.49 -47.53 83.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 117.268 -1.349 . . . . 0.0 114.358 172.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -87.0 -28.32 22.71 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 122.416 2.371 . . . . 0.0 106.776 -172.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -65.35 -37.57 87.45 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 119.22 -0.992 . . . . 0.0 113.599 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -75.98 -37.66 58.28 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -81.71 -22.16 37.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.491 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.1 mt -75.94 -41.46 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.116 0 CA-C-N 118.624 0.647 . . . . 0.0 110.065 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.0 m -67.88 -34.77 77.31 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.089 0.404 . . . . 0.0 111.092 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -70.51 -34.74 72.65 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -69.19 -25.13 64.18 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.494 0.317 . . . . 0.0 110.922 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.81 -5.18 35.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.332 0.653 . . . . 0.0 111.552 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.2 -3.86 43.96 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.473 0.559 . . . . 0.0 113.02 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.8 m -78.79 164.56 3.26 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 CA-C-N 117.777 0.789 . . . . 0.0 112.522 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -67.37 149.1 50.75 Favored 'General case' 0 C--N 1.338 0.088 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -84.17 149.06 54.78 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.889 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.33 150.0 70.28 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.127 2.551 . . . . 0.0 110.589 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -85.24 -18.18 34.77 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 176.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 35.7 m -150.51 155.44 39.49 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.41 0.684 . . . . 0.0 110.982 176.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 91.7 t -144.01 147.92 19.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 123.644 0.777 . . . . 0.0 110.072 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -149.71 141.75 23.91 Favored 'General case' 0 N--CA 1.457 -0.081 0 C-N-CA 123.311 0.644 . . . . 0.0 109.369 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.71 142.74 31.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 123.227 0.611 . . . . 0.0 112.089 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -155.94 -173.8 4.68 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 99.0 p -138.53 -171.08 2.97 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.276 1.031 . . . . 0.0 110.115 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.52 7.77 57.79 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 119.779 -0.456 . . . . 0.0 112.326 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -125.56 -14.03 6.41 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 117.594 0.697 . . . . 0.0 112.154 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 34.8 t -162.23 148.31 13.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.861 0.464 . . . . 0.0 110.502 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -97.76 -8.07 29.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.916 0.486 . . . . 0.0 110.614 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -85.03 -38.64 18.95 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.245 0.618 . . . . 0.0 112.116 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 3.6 m -161.82 165.41 27.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.938 0.495 . . . . 0.0 111.816 -172.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 66.2 m -80.04 170.21 16.78 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.612 0.765 . . . . 0.0 111.697 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.2 m -142.97 165.06 28.38 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 124.392 1.077 . . . . 0.0 108.688 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.0 -170.08 43.23 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.046 -178.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.84 158.81 29.47 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.908 0.883 . . . . 0.0 110.349 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.3 mt -139.96 158.71 43.64 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 108.665 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.6 148.63 28.87 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.171 -0.331 . . . . 0.0 111.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -123.77 170.91 10.06 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 124.818 1.247 . . . . 0.0 112.644 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -74.81 -10.64 59.7 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.739 0.415 . . . . 0.0 111.037 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.4 t -156.48 160.39 39.51 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.678 -0.639 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -69.81 -30.67 68.25 Favored 'General case' 0 C--N 1.337 0.055 0 C-N-CA 122.412 0.285 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.4 p -75.36 -27.38 59.12 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -74.16 -32.49 63.14 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.597 0.359 . . . . 0.0 111.22 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.21 -36.95 58.35 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 175.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 37.3 tp -70.57 -37.4 73.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 122.321 -0.237 . . . . 0.0 111.446 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -70.69 -39.82 73.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.251 0.8 OUTLIER -68.99 -20.25 64.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 175.261 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.05 -42.55 89.37 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.18 -30.13 75.27 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.684 -0.509 . . . . 0.0 111.949 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.337 9.6 m-85 -96.74 -2.97 43.27 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 66.0 mt -127.25 -9.13 5.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -73.87 147.01 43.65 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.689 1.132 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.456 ' CD2' HD21 ' A' ' 479' ' ' ASN . 2.0 t-80 57.58 22.12 7.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.807 0.843 . . . . 0.0 112.204 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.34 134.78 56.95 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -77.16 119.29 20.64 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 122.285 -0.26 . . . . 0.0 110.729 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 74.6 mtm -83.57 152.69 24.73 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.148 0.499 . . . . 0.0 112.107 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -73.6 166.39 23.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.123 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -146.22 145.04 22.79 Favored Pre-proline 0 CA--C 1.531 0.226 0 C-N-CA 122.176 0.19 . . . . 0.0 110.946 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.59 -34.02 3.64 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.174 2.583 . . . . 0.0 112.091 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -152.29 4.57 0.39 Allowed 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -69.18 146.46 44.46 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 -176.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.13 -18.46 21.07 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.841 3.027 . . . . 0.0 111.4 178.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -151.22 151.74 29.87 Favored Pre-proline 0 N--CA 1.455 -0.206 0 N-CA-C 114.598 1.332 . . . . 0.0 114.598 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.15 162.97 40.3 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.953 2.435 . . . . 0.0 110.849 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -129.91 142.31 50.67 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 103.348 -2.834 . . . . 0.0 103.348 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.6 OUTLIER -85.08 139.06 32.02 Favored 'General case' 0 CA--C 1.528 0.135 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -176.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 4.6 tt -85.22 145.79 27.4 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.47 151.92 51.84 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.044 -0.663 . . . . 0.0 111.036 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.62 165.14 37.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.583 0.552 . . . . 0.0 111.678 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 23.0 p -163.78 175.81 10.13 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.192 0.997 . . . . 0.0 110.257 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -58.89 125.49 23.77 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.414 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 35.6 t -82.17 152.07 26.63 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -171.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.3 t -118.26 12.71 13.53 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 169.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.05 161.3 24.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.826 0.85 . . . . 0.0 111.907 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -92.08 -3.2 56.05 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.414 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -152.84 169.98 21.46 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 123.84 0.856 . . . . 0.0 110.477 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.49 25.86 0.96 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.644 0.778 . . . . 0.0 110.148 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.502 -175.947 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.538 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.688 1 O4'-C1'-N19 112.379 4.179 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.647 0 C5'-C4'-C3' 110.406 -3.396 . 0.465 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.555 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.939 1 O4'-C1'-N19 112.552 4.352 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.98 0 C5'-C4'-C3' 111.357 -2.762 . 0.0 OUTLIER '7D dist 4p' 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.776 1 O4'-C1'-N19 112.45 4.25 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.528 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.613 0 C5'-C4'-C3' 110.103 -3.598 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.838 0 O4'-C1'-N19 110.616 2.416 . 0.012 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.942 0 C3'-C2'-C1' 104.257 3.064 . 0.014 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.414 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.421 -2.666 0 O4'-C1'-N19 111.282 3.082 . 0.236 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 1 C5'-C4'-C3' 108.669 -4.554 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.278 16.4 t80 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -176.39 175.04 47.38 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 111.691 -0.564 . . . . 0.0 111.691 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -59.49 171.56 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 124.785 3.657 . . . . 0.0 112.969 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -150.0 155.99 40.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.276 0.63 . . . . 0.0 110.019 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.53 160.34 27.69 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.709 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.13 -0.92 33.68 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . 0.412 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 36.1 t -155.19 148.58 18.49 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.921 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 44.2 Cg_exo -60.79 -4.07 3.26 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 124.539 3.493 . . . . 0.0 113.945 176.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 p -139.67 157.22 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.106 0 CA-C-O 121.514 0.673 . . . . 0.0 109.319 -174.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.95 160.71 26.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.76 1.624 . . . . 0.0 109.09 -174.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 17.3 tpt -136.65 133.65 36.45 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 122.566 0.347 . . . . 0.0 110.717 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -126.93 152.68 35.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.493 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.7 m-85 -140.26 173.88 11.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.14 11.81 75.17 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 120.004 -0.331 . . . . 0.0 112.396 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 47.7 mt -78.74 23.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 117.396 0.598 . . . . 0.0 111.181 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.27 10.5 p30 -74.24 26.85 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -173.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.46 156.55 45.18 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.282 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 25.6 m -68.44 -7.29 30.54 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.422 0.689 . . . . 0.0 112.362 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.27 -14.71 61.37 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 94.2 mmm -100.99 149.6 23.76 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.516 0.598 . . . . 0.0 111.586 -178.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -157.19 151.03 24.47 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.88 0.872 . . . . 0.0 109.336 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 25.0 p -59.27 -39.45 82.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -174.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -72.02 -34.82 69.14 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.316 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -76.09 -48.26 21.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.452 0.301 . . . . 0.0 111.499 -174.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.5 p -67.42 -37.4 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -76.9 -32.06 57.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -171.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -76.2 -32.44 58.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 119.589 1.086 . . . . 0.0 110.114 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.0 t -58.21 -54.62 30.06 Favored 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.8 OUTLIER -76.52 -4.18 41.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 172.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.9 -30.74 61.37 Favored 'General case' 0 C--N 1.338 0.073 0 O-C-N 121.912 -0.492 . . . . 0.0 110.428 177.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . 0.416 HD12 ' C ' ' A' ' 402' ' ' LEU . 2.9 pp -58.11 -18.23 23.7 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.973 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -82.86 -10.48 58.82 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.94 -156.47 24.84 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 118.345 0.52 . . . . 0.0 112.287 -176.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -96.94 131.61 43.55 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.546 -0.385 . . . . 0.0 111.052 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.01 165.51 8.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -119.18 -70.68 0.78 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 14.8 pttp -154.48 168.36 26.97 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.2 p -137.32 149.8 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.187 0.995 . . . . 0.0 110.704 -177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -150.72 121.31 7.45 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.316 0.646 . . . . 0.0 111.51 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -85.21 158.92 20.22 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 13.4 mmt -116.37 133.49 55.95 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.55 ' HE2' " H3'" ' B' ' 4' ' ' ' C' . 32.3 mttp -79.36 -23.79 43.11 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 124.254 1.022 . . . . 0.0 111.619 178.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 40.3 t -77.81 -19.63 54.64 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -170.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -113.12 156.96 42.14 Favored Pre-proline 0 CA--C 1.527 0.094 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.32 -15.17 47.23 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.617 2.211 . . . . 0.0 110.451 176.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.27 106.09 0.2 Allowed Glycine 0 C--N 1.338 0.642 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 175.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.83 157.36 29.06 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.41 0.684 . . . . 0.0 110.044 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.12 156.42 21.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.599 0.237 . . . . 0.0 111.636 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 64.5 mtm -102.49 154.11 19.42 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.338 0.655 . . . . 0.0 109.75 171.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 12.0 t -140.27 115.13 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 122.88 0.472 . . . . 0.0 111.23 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -93.77 133.42 37.16 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 44.3 mtp -154.75 172.43 17.95 Favored 'General case' 0 C--N 1.335 -0.045 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -171.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.69 118.13 8.47 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 168.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -72.4 -33.37 67.12 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -167.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.17 -88.27 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -71.65 -30.62 65.94 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.17 -32.71 18.48 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.564 -0.855 . . . . 0.0 112.729 -173.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 61.1 t -88.38 -24.08 6.22 Favored 'Isoleucine or valine' 0 C--N 1.343 0.296 0 CA-C-N 119.987 1.267 . . . . 0.0 109.685 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -66.07 -50.82 62.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.408 172.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -64.27 -34.51 78.29 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.23 82.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.5 0.591 . . . . 0.0 110.296 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.1 mt -79.17 -8.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.223 0.609 . . . . 0.0 111.089 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 37.6 m -100.61 -18.79 16.41 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 177.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -125.73 -29.82 3.1 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 -169.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 94.6 mt -134.36 -10.06 2.52 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 120.449 1.477 . . . . 0.0 114.151 -170.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.655 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.2 p-10 -71.38 100.74 2.24 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.8 m-80 76.72 21.44 1.24 Allowed 'General case' 0 N--CA 1.479 1.025 0 O-C-N 117.795 -3.066 . . . . 0.0 112.477 -162.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -79.61 158.44 27.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 170.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.29 46.7 m-85 -72.85 42.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -174.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . 0.422 ' HG2' ' CD2' ' A' ' 442' ' ' PHE . 16.0 ttt -59.74 145.98 43.14 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.791 -0.568 . . . . 0.0 110.43 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . 0.422 ' CD2' ' HG2' ' A' ' 441' ' ' MET 0.289 62.0 m-85 55.92 8.82 0.39 Allowed 'General case' 0 C--O 1.231 0.104 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 72.62 13.58 77.95 Favored Glycine 0 CA--C 1.53 0.974 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -175.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -133.02 -4.41 3.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.672 0.736 . . . . 0.0 112.19 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 62.99 150.99 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.439 1.496 . . . . 0.0 114.069 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.55 110.4 7.19 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 171.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.573 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.5 m120 -65.61 130.33 42.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 115.885 -2.007 . . . . 0.0 112.061 -171.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.655 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.426 1.9 t -127.62 150.08 33.14 Favored 'Isoleucine or valine' 0 C--N 1.362 1.145 0 C-N-CA 113.031 -3.468 . . . . 0.0 116.249 169.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.7 t -161.04 172.38 16.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.778 1.231 . . . . 0.0 108.139 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.9 p -71.24 146.7 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . 0.411 ' HA ' ' N3 ' ' B' ' 2' ' ' ' C' . 17.4 t -80.47 155.77 26.89 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 122.861 0.464 . . . . 0.0 111.192 177.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.517 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 62.9 pttt -103.43 -4.01 24.66 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 121.959 0.104 . . . . 0.0 111.068 177.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -82.93 156.18 67.43 Favored Pre-proline 0 N--CA 1.455 -0.181 0 C-N-CA 123.038 0.535 . . . . 0.0 110.276 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -74.84 -37.75 2.01 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.89 2.394 . . . . 0.0 112.144 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.89 163.16 11.57 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.511 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 69.7 mt -82.3 138.76 18.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 45.8 mmm -102.2 123.65 42.56 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 122.67 0.388 . . . . 0.0 110.506 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -73.7 153.47 48.69 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.19 2.593 . . . . 0.0 109.374 174.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.8 -123.81 1.39 Allowed Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.907 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -72.49 163.85 27.35 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.914 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 470' ' ' SER . 97.5 p -151.21 176.22 11.41 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.123 0.969 . . . . 0.0 109.351 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -136.93 7.08 2.93 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.335 -0.228 . . . . 0.0 111.127 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.55 -172.71 55.14 Favored Glycine 0 CA--C 1.526 0.734 0 O-C-N 122.202 -0.311 . . . . 0.0 112.47 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 75.2 mt -144.92 170.09 16.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.761 1.224 . . . . 0.0 109.586 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -70.09 -28.81 65.71 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.001 -0.437 . . . . 0.0 111.129 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -120.62 9.71 10.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -142.05 164.3 26.86 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 91.8 p -94.51 -22.56 18.16 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.592 0.357 . . . . 0.0 111.94 -176.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.5 t -127.01 146.88 50.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.878 0.471 . . . . 0.0 110.328 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . 0.423 ' H ' ' HB2' ' A' ' 461' ' ' SER . 89.0 p -88.65 9.54 23.83 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.779 0.832 . . . . 0.0 110.838 176.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -141.34 150.7 42.81 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.002 1.321 . . . . 0.0 114.328 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -155.93 148.07 23.43 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.992 0.36 . . . . 0.0 111.099 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -100.74 146.35 27.34 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 178.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -140.38 1.45 1.77 Allowed 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 89.8 p -66.28 -19.35 65.79 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.337 0.655 . . . . 0.0 112.039 -177.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -114.03 2.86 15.11 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.512 0.725 . . . . 0.0 111.152 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -76.15 150.03 37.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.976 0.417 . . . . 0.0 111.611 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . 0.411 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 60.5 ttt180 -81.44 -11.88 59.1 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.538 0.735 . . . . 0.0 110.656 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -66.22 -18.12 65.16 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -63.33 131.1 47.19 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.718 0.407 . . . . 0.0 110.457 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.2 tpt85 -80.93 -33.77 33.83 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.318 62.9 m-85 -98.0 9.14 43.52 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 117.889 2.551 . . . . 0.0 117.889 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 28.2 m -75.53 -3.58 34.99 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.04 147.72 61.86 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -71.7 -24.77 21.29 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.269 2.646 . . . . 0.0 111.466 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -82.87 -25.78 32.21 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.003 0.365 . . . . 0.0 110.601 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -80.07 -43.94 20.93 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.143 -0.348 . . . . 0.0 110.185 173.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -58.76 -18.63 33.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.02 -19.24 44.31 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -124.05 8.13 8.62 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -65.13 154.11 38.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.135 0.425 . . . . 0.0 111.448 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.406 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 10.9 ptp180 -151.42 137.07 17.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.8 mm -141.55 140.57 31.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.058 0 C-N-CA 123.526 0.73 . . . . 0.0 109.39 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -149.42 169.28 21.23 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.07 0.948 . . . . 0.0 109.948 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -60.15 152.92 59.87 Favored Pre-proline 0 N--CA 1.455 -0.185 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.37 156.12 61.92 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.996 2.464 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 44.3 t -154.83 175.77 13.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.7 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -83.66 -4.86 58.95 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.283 -0.26 . . . . 0.0 110.423 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.5 t -94.01 138.2 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 176.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.45 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 82.9 mt -126.31 153.7 44.48 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.268 0.627 . . . . 0.0 109.855 175.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -124.0 131.1 53.52 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -123.93 158.41 32.05 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 -176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -143.75 150.59 38.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -174.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 50.93 57.09 7.03 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.748 1.219 . . . . 0.0 112.728 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.12 160.58 25.51 Favored Pre-proline 0 N--CA 1.454 -0.251 0 C-N-CA 123.594 0.758 . . . . 0.0 110.265 175.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.46 152.1 27.81 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.265 2.643 . . . . 0.0 112.535 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.57 -16.51 63.89 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.872 0.469 . . . . 0.0 111.934 -177.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -122.94 25.88 8.38 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.876 0.87 . . . . 0.0 110.751 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -64.61 -13.91 15.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.647 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.5 OUTLIER -54.81 -177.41 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -165.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.647 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.46 -39.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -169.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 98.0 mt-10 -59.74 -43.65 94.16 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 172.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.96 -28.78 21.25 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 122.181 2.264 . . . . 0.0 106.873 -174.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -66.98 -33.34 75.36 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -76.53 -42.19 44.03 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -73.2 -26.34 61.12 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 75.6 mt -76.9 -41.33 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.162 0.437 . . . . 0.0 110.902 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 89.8 m -68.34 -35.09 77.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.178 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -69.45 -38.49 77.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -71.1 -27.74 63.81 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.509 0.323 . . . . 0.0 111.533 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.8 mt -93.53 -4.1 51.64 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 122.8 0.44 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.07 32.56 58.4 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.943 -0.473 . . . . 0.0 112.626 175.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.6 m -127.03 164.68 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 117.554 0.677 . . . . 0.0 111.585 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.52 142.9 57.36 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -83.58 153.8 65.08 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.25 146.66 76.56 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 123.017 2.478 . . . . 0.0 110.729 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.1 t -85.01 -15.82 42.88 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.0 t -150.32 153.08 35.47 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 122.808 0.443 . . . . 0.0 109.878 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 72.8 t -141.67 145.3 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.129 0 C-N-CA 123.39 0.676 . . . . 0.0 109.91 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -145.81 138.12 25.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.352 0.661 . . . . 0.0 109.365 176.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 18.4 t -141.77 140.16 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 C-N-CA 123.667 0.787 . . . . 0.0 110.393 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -155.36 169.08 25.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 -176.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 93.3 p -79.53 170.47 16.52 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.806 0.842 . . . . 0.0 111.485 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 82.68 -174.38 53.04 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.941 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 62.7 -19.44 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.151 1.78 . . . . 0.0 113.86 -177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 43.8 t -161.67 157.93 25.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 110.228 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -116.96 -7.77 11.34 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.505 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -88.14 -34.8 17.74 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 123.363 0.665 . . . . 0.0 112.237 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 4.0 m -160.59 170.68 20.38 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.016 0.526 . . . . 0.0 111.283 -173.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.4 t -79.89 165.5 22.61 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.44 0.696 . . . . 0.0 111.567 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 71.6 m -147.89 161.8 40.57 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.413 1.085 . . . . 0.0 109.588 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.56 -170.6 43.74 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.963 -178.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -119.16 159.96 23.01 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.943 0.897 . . . . 0.0 110.356 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.2 mt -141.46 159.79 41.49 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 108.94 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -150.26 149.22 29.86 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 117.782 0.264 . . . . 0.0 111.355 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . 0.45 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 13.0 m-90 -124.42 171.91 9.57 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 124.986 1.314 . . . . 0.0 112.48 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -74.48 -12.38 60.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.389 0.276 . . . . 0.0 110.478 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.5 t -157.51 156.06 31.37 Favored 'General case' 0 C--O 1.232 0.134 0 O-C-N 121.707 -0.62 . . . . 0.0 111.135 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -23.24 63.45 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 122.256 -0.278 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 51.3 m -78.22 -25.29 46.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -78.09 -32.23 50.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.54 0.336 . . . . 0.0 110.708 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.07 -25.56 58.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.334 -0.228 . . . . 0.0 110.431 175.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 60.1 tp -74.66 -41.58 60.04 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.274 -0.266 . . . . 0.0 110.962 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -69.77 -35.74 75.16 Favored 'General case' 0 N--CA 1.456 -0.145 0 O-C-N 121.965 -0.459 . . . . 0.0 109.903 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.95 -23.57 55.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 177.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.84 -39.44 90.79 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -67.89 -37.35 88.08 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.339 27.7 m-85 -84.47 -4.59 59.02 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 118.85 2.907 . . . . 0.0 118.85 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 85.5 mt -122.15 -22.0 5.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.049 0.84 . . . . 0.0 113.09 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -70.85 139.17 50.77 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 119.369 0.986 . . . . 0.0 110.388 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 58.91 12.78 2.47 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.645 1.178 . . . . 0.0 112.968 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.268 36.6 t80 -71.25 140.8 50.52 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 177.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -72.2 137.8 47.14 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.156 -0.34 . . . . 0.0 111.704 -175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.9 mtm -83.41 145.28 29.08 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 122.356 0.263 . . . . 0.0 110.802 177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -81.07 166.25 20.91 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -148.79 149.57 30.87 Favored Pre-proline 0 CA--C 1.53 0.181 0 C-N-CA 122.644 0.378 . . . . 0.0 110.803 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -74.13 -27.97 11.27 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 112.112 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 37.7 p30 -160.3 8.78 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -68.01 149.46 50.27 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -176.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.04 -26.05 13.35 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.622 2.882 . . . . 0.0 111.489 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -154.9 148.04 18.26 Favored Pre-proline 0 CA--C 1.529 0.154 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -77.87 164.98 27.11 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 123.902 3.068 . . . . 0.0 111.96 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -130.0 142.3 50.65 Favored 'General case' 0 C--O 1.23 0.069 0 N-CA-C 102.618 -3.104 . . . . 0.0 102.618 173.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.262 0.7 OUTLIER -74.64 138.31 42.82 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.7 tt -89.59 147.1 24.12 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.34 158.53 43.88 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.574 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.93 169.36 23.67 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.232 0.539 . . . . 0.0 111.041 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 51.5 t -155.91 164.07 38.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.445 1.098 . . . . 0.0 109.377 -175.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -57.36 121.07 9.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 174.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.461 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 41.5 t -75.79 144.6 41.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -169.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 t -112.25 13.52 20.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.88 -1.054 . . . . 0.0 113.684 169.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.28 162.92 13.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.242 1.017 . . . . 0.0 111.909 -178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -87.35 -3.07 59.02 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.967 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -177.52 176.57 1.26 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.32 1.048 . . . . 0.0 110.081 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -137.19 23.3 3.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.657 0.783 . . . . 0.0 110.917 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.129 -1.415 . . . . 0.0 111.09 -177.195 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.493 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.751 1 O4'-C1'-N19 112.68 4.48 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.517 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C5'-C4'-C3' 110.962 -3.025 . 0.436 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.444 " O5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.78 0 C3'-C2'-C1' 104.892 3.769 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . 0.55 " H3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.417 -2.969 1 P-O3'-C3' 125.998 5.248 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . 0.482 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.939 1 O4'-C1'-N19 112.81 4.61 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.519 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 C5'-C4'-C3' 110.029 -3.647 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.411 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.418 -2.922 0 C5'-C4'-C3' 111.558 -2.628 . 0.01 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C3'-C2'-C1' 104.821 3.69 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.461 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.765 0 O4'-C1'-N19 111.207 3.007 . 0.221 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.62 1 C5'-C4'-C3' 108.802 -4.465 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.262 51.5 m-85 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.12 -174.31 44.31 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.63 170.49 16.3 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 124.16 3.24 . . . . 0.0 111.166 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -151.93 156.4 40.0 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.233 0.613 . . . . 0.0 110.376 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.21 157.45 37.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.676 0.39 . . . . 0.0 110.836 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -83.35 6.69 19.02 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 30.0 t -154.28 145.05 16.11 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.119 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.0 Cg_exo -62.36 -7.39 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.911 3.074 . . . . 0.0 112.686 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.41 154.43 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -173.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.2 tt -132.36 154.55 49.64 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.76 1.624 . . . . 0.0 108.103 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 13.9 tpt -134.95 136.49 42.3 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.308 0.243 . . . . 0.0 110.949 -174.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -130.62 151.59 36.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -175.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.479 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.0 m-85 -137.2 172.74 12.54 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.54 11.11 80.66 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 119.843 -0.421 . . . . 0.0 112.881 176.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.5 mt -77.97 28.04 0.18 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.802 0.801 . . . . 0.0 112.25 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.42 -39.17 91.8 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.437 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.61 148.69 51.56 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.094 0.473 . . . . 0.0 111.147 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.6 p -70.61 -6.72 38.84 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.887 0.875 . . . . 0.0 113.008 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -78.54 -13.45 59.82 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.61 0.364 . . . . 0.0 111.611 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 70.0 mmm -84.69 148.98 26.11 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -163.03 162.21 25.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 16.6 p -59.68 -32.31 70.37 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 122.112 -0.368 . . . . 0.0 111.267 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -73.29 -30.71 63.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 395' ' ' ARG . 1.0 OUTLIER -74.27 -51.67 14.62 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 12.5 m -65.03 -39.0 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.875 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.675 ' CE1' HG13 ' A' ' 406' ' ' VAL 0.358 1.9 m-85 -67.85 -51.89 43.04 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 175.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -58.08 -36.34 72.71 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.255 -173.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 28.5 t -60.4 -64.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.334 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.504 5.3 p90 -76.51 -5.82 49.17 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 118.226 2.676 . . . . 0.0 118.226 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.62 -32.42 53.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.998 0.519 . . . . 0.0 110.036 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -59.2 -17.73 30.25 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.008 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -89.87 -17.5 27.94 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.73 179.36 44.32 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 118.494 0.588 . . . . 0.0 112.941 -176.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -75.33 146.74 40.7 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -175.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.675 HG13 ' CE1' ' A' ' 397' ' ' PHE . 24.1 t -114.15 163.35 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.979 1.311 . . . . 0.0 113.206 -172.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.483 ' N ' HG12 ' A' ' 406' ' ' VAL . 64.1 mm-40 -132.87 -66.89 0.65 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.192 -0.432 . . . . 0.0 111.726 174.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -153.31 156.51 38.51 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.745 0.702 . . . . 0.0 112.833 -175.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . 0.535 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.8 p -141.43 148.03 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 174.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -153.5 123.88 7.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.617 0.246 . . . . 0.0 111.312 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -74.76 162.37 28.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 66.4 mtm -135.11 126.67 28.8 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 121.347 0.594 . . . . 0.0 112.118 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -5.58 54.65 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 124.509 1.124 . . . . 0.0 111.801 176.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 91.6 p -77.96 -4.02 44.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.759 0.424 . . . . 0.0 111.208 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.429 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.5 mmtm -138.49 158.51 70.35 Favored Pre-proline 0 CA--C 1.529 0.159 0 C-N-CA 124.492 1.117 . . . . 0.0 109.484 178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.32 -13.68 40.93 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.149 2.566 . . . . 0.0 111.614 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.32 99.27 0.12 Allowed Glycine 0 C--N 1.336 0.534 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 175.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.94 156.76 35.1 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.814 0.446 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -155.95 146.28 21.68 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 111.219 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 81.4 mtp -88.61 147.84 24.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 4.1 t -142.13 118.5 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -102.34 134.17 46.06 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 70.0 mtp -153.71 173.91 15.21 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 -176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.472 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.58 116.96 7.38 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -72.25 -33.24 67.36 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -167.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.83 -87.35 0.02 OUTLIER Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -74.31 -24.42 59.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.93 -34.92 16.74 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.974 -176.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 69.9 t -84.84 -25.04 7.02 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 118.573 -1.251 . . . . 0.0 109.041 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -66.66 -54.29 24.72 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.913 0.324 . . . . 0.0 111.647 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -64.3 -37.21 86.7 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.52 -35.13 77.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.239 0.472 . . . . 0.0 110.786 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.67 -10.68 12.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.523 0.329 . . . . 0.0 110.919 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 58.6 m -96.76 -20.31 18.31 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -125.61 -31.48 2.97 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.483 HD23 HD22 ' A' ' 439' ' ' ASN . 90.8 mt -134.26 -7.26 2.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.333 1.424 . . . . 0.0 114.299 -169.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.1 p-10 -71.17 100.94 2.16 Favored 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 -170.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 9.2 m-80 76.92 21.23 1.18 Allowed 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 123.97 3.077 . . . . 0.0 112.156 -162.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . 0.483 HD22 HD23 ' A' ' 436' ' ' LEU . 55.7 t30 -84.76 159.44 20.47 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 169.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -75.85 138.8 41.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -160.25 145.58 14.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.566 0.746 . . . . 0.0 109.081 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 60.06 15.57 5.22 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.07 11.41 84.46 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -133.94 -161.44 1.14 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.608 1.563 . . . . 0.0 108.47 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.16 151.14 50.39 Favored 'General case' 0 N--CA 1.461 0.082 0 O-C-N 121.963 -0.461 . . . . 0.0 110.683 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -130.34 91.12 3.04 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.613 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.6 m120 -58.93 128.21 36.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 115.863 -2.018 . . . . 0.0 111.721 -173.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.42 1.9 t -128.21 150.47 33.98 Favored 'Isoleucine or valine' 0 C--N 1.367 1.348 0 C-N-CA 113.113 -3.435 . . . . 0.0 116.076 170.157 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 48.6 t -159.94 167.84 27.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.298 1.439 . . . . 0.0 108.618 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -70.74 148.93 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 177.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 21.4 t -85.01 158.13 20.56 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.783 0.433 . . . . 0.0 111.497 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.401 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 64.1 pttt -107.44 -1.33 21.57 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.386 0.275 . . . . 0.0 111.45 176.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -85.13 149.01 51.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 C-N-CA 122.792 0.437 . . . . 0.0 110.621 175.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.47 -33.57 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.211 2.607 . . . . 0.0 112.542 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.07 157.79 11.71 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.064 0.393 . . . . 0.0 111.715 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 81.2 mt -83.39 145.23 8.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.4 mtp -114.75 126.98 27.26 Favored Pre-proline 0 CA--C 1.532 0.256 0 O-C-N 122.342 -0.224 . . . . 0.0 110.844 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.13 173.6 14.15 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 124.134 3.223 . . . . 0.0 110.286 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 136.63 -107.78 0.62 Allowed Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.034 -0.827 . . . . 0.0 111.034 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.37 158.34 35.96 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.326 0.65 . . . . 0.0 111.054 -177.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 40.6 t -161.1 163.81 31.15 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.8 0.84 . . . . 0.0 109.466 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -130.56 0.41 4.45 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.03 -177.3 54.37 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 122.934 0.302 . . . . 0.0 112.491 -178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 96.5 mt -143.7 157.75 44.17 Favored 'General case' 0 N--CA 1.458 -0.073 0 C-N-CA 124.343 1.057 . . . . 0.0 109.338 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 465' ' ' GLU . 10.5 pm0 -71.82 -10.22 59.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.779 0.431 . . . . 0.0 112.073 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -120.48 20.25 11.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.323 0.649 . . . . 0.0 110.237 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -168.35 -151.74 7.27 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.0 t -133.05 -16.1 2.52 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.8 p -127.06 146.82 50.23 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.374 0.669 . . . . 0.0 111.4 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 93.1 p -92.44 -0.11 57.39 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.862 0.465 . . . . 0.0 110.434 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -126.81 144.96 50.81 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -155.37 156.68 35.85 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.257 0.2 OUTLIER -136.69 142.74 43.15 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -129.24 12.33 6.03 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 32.2 t -64.04 -25.14 67.98 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.465 0.706 . . . . 0.0 112.013 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -114.0 3.84 15.49 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.351 0.661 . . . . 0.0 111.62 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 45.4 t -75.82 153.6 36.77 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 120.947 0.403 . . . . 0.0 111.687 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . 0.441 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 54.4 ttt180 -83.42 -14.48 52.54 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.259 0.624 . . . . 0.0 110.717 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -63.24 -22.29 66.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.121 0.568 . . . . 0.0 112.255 -174.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -58.03 130.83 48.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -68.88 -33.84 74.45 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -170.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.413 56.9 m-85 -98.0 17.35 18.53 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.1 t -61.58 -25.73 67.51 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -172.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.57 151.84 76.72 Favored Pre-proline 0 C--O 1.232 0.14 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -177.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.09 -15.66 39.77 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.006 2.471 . . . . 0.0 109.872 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.8 -32.73 60.0 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -80.6 -47.09 14.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 174.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.78 -21.43 65.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -75.94 -22.55 55.86 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.22 -0.3 . . . . 0.0 111.647 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -124.05 -1.81 8.24 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -60.25 153.93 21.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.425 0.557 . . . . 0.0 111.655 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -152.86 147.34 25.89 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.5 mm -135.82 147.55 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 C-N-CA 123.252 0.621 . . . . 0.0 109.578 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -156.56 160.54 39.56 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.019 0.528 . . . . 0.0 110.044 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -61.01 155.09 56.78 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 122.749 0.42 . . . . 0.0 109.999 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.68 146.67 89.13 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.099 2.533 . . . . 0.0 111.065 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 92.5 p -151.48 176.66 11.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.552 0.741 . . . . 0.0 109.627 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -83.71 -2.14 55.59 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.03 142.93 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 123.199 0.6 . . . . 0.0 112.124 175.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 6.2 tp -137.69 151.75 48.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -124.22 149.99 45.77 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.783 0.833 . . . . 0.0 109.149 -177.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -142.11 159.9 41.29 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.612 0.72 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -149.69 160.04 43.85 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 102.719 -3.067 . . . . 0.0 102.719 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 58.45 57.39 3.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.327 -0.233 . . . . 0.0 111.472 -174.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -123.17 148.51 54.9 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 122.589 0.356 . . . . 0.0 111.202 176.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.24 155.47 29.45 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.67 2.913 . . . . 0.0 112.794 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.16 -16.38 63.97 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.324 0.649 . . . . 0.0 111.724 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -120.33 20.95 11.85 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.69 0.796 . . . . 0.0 111.183 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.58 -13.91 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.82 -177.3 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -166.158 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -24.05 -40.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.6 mt-10 -58.53 -46.22 87.27 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.289 -1.338 . . . . 0.0 114.449 173.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -87.93 -27.96 21.8 Favored 'General case' 0 C--N 1.351 0.635 0 CA-C-N 122.653 2.479 . . . . 0.0 106.669 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -63.7 -38.07 89.72 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -75.6 -42.7 51.19 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -75.07 -20.91 59.29 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.132 -177.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -77.29 -39.92 28.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 118.268 0.486 . . . . 0.0 110.032 175.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 88.7 m -69.02 -31.39 70.17 Favored 'General case' 0 N--CA 1.456 -0.154 0 O-C-N 122.137 -0.352 . . . . 0.0 110.838 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -72.7 -32.93 66.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.42 0.288 . . . . 0.0 110.692 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -71.74 -27.72 63.18 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.76 -5.96 37.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.818 0.281 . . . . 0.0 111.68 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.93 -7.83 8.91 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 123.678 0.656 . . . . 0.0 113.362 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.2 m -77.34 174.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 118.41 1.105 . . . . 0.0 112.784 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.73 164.52 6.07 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 123.295 0.638 . . . . 0.0 111.922 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -127.16 150.14 71.45 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.587 0.755 . . . . 0.0 109.281 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.11 154.68 69.92 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.095 2.53 . . . . 0.0 111.631 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.9 t -89.33 -17.11 29.56 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 17.3 t -155.48 155.27 33.17 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.523 0.329 . . . . 0.0 110.208 177.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.5 m -141.79 155.22 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -147.56 141.2 25.57 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.597 0.759 . . . . 0.0 109.473 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.33 141.91 29.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.302 0.641 . . . . 0.0 111.796 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -155.23 167.57 29.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -91.02 175.14 7.06 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.917 0.887 . . . . 0.0 110.785 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 95.26 177.07 37.55 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 123.591 0.615 . . . . 0.0 111.71 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 49.7 13.34 0.09 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.701 2.0 . . . . 0.0 114.432 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 40.1 t -160.85 157.65 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 123.797 0.839 . . . . 0.0 109.766 177.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -117.09 6.17 12.86 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -141.22 -10.62 0.96 Allowed 'General case' 0 C--N 1.341 0.198 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 45.2 t -154.31 163.85 39.5 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.463 0.574 . . . . 0.0 111.707 -170.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 60.1 p -90.11 173.63 8.07 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 111.349 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.5 m -145.72 165.8 27.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.595 1.158 . . . . 0.0 108.786 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.56 -174.27 46.06 Favored Glycine 0 CA--C 1.525 0.661 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.959 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.82 161.3 22.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.792 0.837 . . . . 0.0 110.299 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 79.1 mt -140.64 161.57 37.45 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.885 1.274 . . . . 0.0 108.784 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -148.05 149.76 32.68 Favored 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.936 0.346 . . . . 0.0 111.936 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -127.48 172.14 10.96 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.638 1.575 . . . . 0.0 112.333 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.21 -9.99 59.16 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.4 t -161.38 158.45 26.89 Favored 'General case' 0 C--O 1.23 0.06 0 C-N-CA 123.092 0.557 . . . . 0.0 110.339 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -73.52 -19.87 60.81 Favored 'General case' 0 CA--C 1.527 0.074 0 O-C-N 122.294 -0.254 . . . . 0.0 111.175 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 86.7 p -79.83 -25.48 40.78 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.92 0.327 . . . . 0.0 110.158 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -76.81 -35.85 57.33 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.323 0.249 . . . . 0.0 111.173 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.32 62.14 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 36.0 tp -73.89 -41.48 62.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.895 0.478 . . . . 0.0 110.12 178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -63.07 -47.07 84.49 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.061 0.457 . . . . 0.0 110.551 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -26.1 63.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 177.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.4 -38.9 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -63.78 -40.46 98.49 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.355 30.1 m-85 -91.13 -3.66 56.88 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 119.362 3.097 . . . . 0.0 119.362 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 74.5 mt -120.3 -4.86 9.92 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.498 1.045 . . . . 0.0 113.482 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -74.66 143.61 44.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.344 0.974 . . . . 0.0 108.54 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 58.07 19.28 5.87 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.591 0.757 . . . . 0.0 112.331 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -71.31 155.47 40.63 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -177.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -70.54 157.9 37.07 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 69.2 mtm -126.66 152.71 46.37 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.187 0.595 . . . . 0.0 111.917 173.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -74.83 161.0 29.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 169.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -153.61 118.01 2.76 Favored Pre-proline 0 CA--C 1.531 0.247 0 O-C-N 121.991 -0.443 . . . . 0.0 110.817 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -80.6 -16.37 10.5 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.32 2.68 . . . . 0.0 111.864 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.01 -7.8 58.98 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 173.68 170.65 37.38 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.94 -21.14 21.31 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.698 2.932 . . . . 0.0 111.6 -178.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -82.62 131.74 54.1 Favored Pre-proline 0 N--CA 1.454 -0.232 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -83.57 169.25 12.35 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.616 2.877 . . . . 0.0 111.143 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -130.03 142.32 50.63 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 102.834 -3.024 . . . . 0.0 102.834 172.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -76.65 137.14 39.25 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 116.316 1.969 . . . . 0.0 116.316 -175.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.7 tt -87.42 150.03 24.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.437 1.095 . . . . 0.0 108.625 173.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -141.43 153.95 45.3 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.48 161.44 40.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.938 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 17.5 p -163.27 171.28 16.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.281 0.633 . . . . 0.0 111.626 -175.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -54.34 121.67 8.76 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.413 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 39.4 t -80.52 149.04 30.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -169.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.273 1.0 OUTLIER -111.68 9.22 20.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 169.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -70.41 168.75 15.4 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.261 1.025 . . . . 0.0 111.801 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -95.47 -3.12 47.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -175.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.74 178.03 4.24 Favored 'General case' 0 C--N 1.338 0.086 0 C-N-CA 123.346 0.659 . . . . 0.0 110.216 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.2 31.49 1.37 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.776 0.43 . . . . 0.0 111.768 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.252 1.192 0 CA-C-O 117.779 -1.105 . . . . 0.0 110.942 -178.879 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.479 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.692 1 O4'-C1'-N19 112.718 4.518 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.401 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 C5'-C4'-C3' 110.645 -3.237 . 0.428 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.702 2 C5'-C4'-C3' 106.239 -6.174 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 1 C5'-C4'-C3' 109.23 -4.18 . 0.01 2u . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.912 1 O4'-C1'-N19 114.009 5.809 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.486 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.624 0 C5'-C4'-C3' 109.77 -3.82 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.441 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.42 -2.734 0 O4'-C1'-N19 111.978 3.778 . 0.037 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C3'-C2'-C1' 104.566 3.407 . 0.107 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.413 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.418 -2.911 0 C5'-C4'-C3' 111.516 -2.656 . 0.279 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 2 C5'-C4'-C3' 108.113 -4.925 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . 0.523 ' N ' ' HH ' ' A' ' 427' ' ' TYR 0.339 6.3 p90 . . . . . 0 N--CA 1.473 0.675 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -77.3 152.33 39.67 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -62.14 151.72 80.22 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.705 2.937 . . . . 0.0 111.943 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -78.2 155.41 30.38 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.952 0.501 . . . . 0.0 110.017 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -71.93 155.47 40.32 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.808 0.337 . . . . 0.0 110.714 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -84.59 7.82 18.86 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 38.3 t -151.6 143.49 16.09 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 122.051 -0.406 . . . . 0.0 110.947 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 31.3 Cg_exo -63.12 -1.39 2.86 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.292 3.328 . . . . 0.0 113.976 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.4 p -143.01 156.24 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-O 121.809 0.814 . . . . 0.0 109.202 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.54 164.17 24.37 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.078 1.751 . . . . 0.0 107.825 -177.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.1 ttt -144.13 138.64 28.32 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.816 0.735 . . . . 0.0 111.855 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.7 154.54 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 C-N-CA 124.136 0.974 . . . . 0.0 108.588 -175.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.402 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 7.8 m-85 -141.89 171.8 13.56 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.94 10.63 75.11 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 112.057 -0.417 . . . . 0.0 112.057 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 53.8 mt -79.03 26.51 0.25 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.761 0.78 . . . . 0.0 111.879 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -62.9 -35.57 80.49 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.455 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.7 pm0 -67.19 150.64 48.82 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.2 p -69.81 -7.17 37.63 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 123.687 0.795 . . . . 0.0 112.705 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -79.12 -7.39 58.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.367 0.667 . . . . 0.0 112.311 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 69.1 mmm -91.27 151.9 20.71 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-N 118.632 0.651 . . . . 0.0 111.259 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -159.54 155.51 26.49 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.574 0.75 . . . . 0.0 109.754 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 10.8 p -60.24 -38.36 83.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -176.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.29 -30.76 63.62 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -75.87 -43.28 46.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.656 0.382 . . . . 0.0 111.082 -177.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.488 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 1.1 m-85 -62.39 -53.39 55.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.099 2.259 . . . . 0.0 117.099 177.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -60.47 -32.49 71.45 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.351 -1.34 . . . . 0.0 109.787 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 11.0 t -60.92 -62.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.553 0.4 OUTLIER -76.54 -8.11 56.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 175.822 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.9 t -73.11 -29.66 63.08 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.917 -0.49 . . . . 0.0 109.951 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . 0.429 HD11 ' CE2' ' A' ' 403' ' ' TYR . 2.0 pp -60.18 -16.26 31.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.074 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . 0.429 ' CE2' HD11 ' A' ' 402' ' ' LEU . 52.2 m-85 -94.87 -6.86 41.77 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.104 2.261 . . . . 0.0 117.104 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 161.2 175.49 32.28 Favored Glycine 0 CA--C 1.527 0.844 0 CA-C-N 118.35 0.523 . . . . 0.0 112.85 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -70.35 137.31 50.47 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 111.719 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.488 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 15.1 m -114.03 165.31 9.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 124.959 1.304 . . . . 0.0 109.397 -176.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -139.39 -54.65 0.57 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -151.39 152.46 33.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.792 1.178 . . . . 0.0 112.972 -176.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 13.9 p -141.5 145.12 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 123.424 0.69 . . . . 0.0 109.914 176.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -153.6 128.23 9.37 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.872 0.469 . . . . 0.0 110.673 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -80.5 147.83 30.7 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 117.08 2.252 . . . . 0.0 117.08 -177.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.1 mmt -83.3 128.55 34.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 123.431 0.692 . . . . 0.0 111.409 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.663 ' HE2' " H3'" ' B' ' 4' ' ' ' C' . 36.6 mttp -79.3 -30.14 42.77 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 122.98 0.512 . . . . 0.0 111.108 173.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 28.4 t -79.77 -19.46 48.6 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 123.925 0.89 . . . . 0.0 112.956 -174.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -108.84 154.15 41.98 Favored Pre-proline 0 N--CA 1.455 -0.191 0 C-N-CA 123.068 0.547 . . . . 0.0 110.179 -175.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -67.96 -17.54 46.34 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.109 2.54 . . . . 0.0 111.293 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.45 103.68 0.17 Allowed Glycine 0 C--N 1.336 0.576 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -163.74 160.74 22.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.49 0.716 . . . . 0.0 109.385 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.47 143.11 16.06 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 79.4 mtp -81.18 149.55 29.05 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.3 t -142.68 102.05 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -84.51 134.38 34.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 75.0 mtp -153.6 171.46 18.73 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 123.723 0.809 . . . . 0.0 109.716 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -67.49 114.73 6.39 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 169.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -72.43 -33.87 67.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -166.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -52.49 -89.16 0.01 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . 0.523 ' HH ' ' N ' ' A' ' 372' ' ' TYR 0.251 55.5 m-85 -77.93 -20.66 52.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 117.389 2.366 . . . . 0.0 117.389 -176.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -89.0 -35.76 16.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 119.021 -1.071 . . . . 0.0 111.673 -176.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.6 t -84.82 -26.67 6.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.221 0 C-N-CA 118.722 -1.191 . . . . 0.0 108.24 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -62.14 -62.88 1.46 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 173.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -65.83 -29.14 69.56 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.34 -36.13 78.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.736 0.698 . . . . 0.0 110.401 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 -11.49 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.907 0.483 . . . . 0.0 110.793 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 3.8 m -94.53 -21.85 18.6 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -130.13 -19.26 3.21 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -169.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.72 -12.33 2.3 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.669 1.577 . . . . 0.0 114.573 -175.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.639 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.6 p-10 -71.51 100.98 2.35 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -169.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.1 m-80 76.91 22.05 1.1 Allowed 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 124.05 3.114 . . . . 0.0 113.21 -162.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.84 159.09 25.17 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.593 -0.692 . . . . 0.0 110.117 167.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.26 137.98 41.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 15.8 ttt -157.77 141.18 15.41 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.256 0.623 . . . . 0.0 109.665 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 58.55 16.65 4.39 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 81.63 11.3 83.18 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -132.66 -161.83 1.17 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.782 1.633 . . . . 0.0 108.373 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -135.78 149.23 49.06 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.886 -0.509 . . . . 0.0 110.8 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -126.39 82.36 2.07 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.446 0.698 . . . . 0.0 109.417 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.1 m120 -54.41 127.95 29.65 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 115.497 -2.192 . . . . 0.0 112.678 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.639 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.0 t -127.77 149.17 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 113.464 -3.294 . . . . 0.0 116.519 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.2 t -160.43 168.55 24.92 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.281 1.432 . . . . 0.0 107.653 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.89 150.07 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.1 t -88.62 157.98 18.4 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.133 0.573 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.447 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 64.6 pttt -105.51 -3.47 22.41 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.446 0.298 . . . . 0.0 111.182 178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -75.49 156.58 85.12 Favored Pre-proline 0 CA--C 1.53 0.207 0 C-N-CA 123.259 0.624 . . . . 0.0 110.467 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.85 -35.47 0.99 Allowed 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.897 2.398 . . . . 0.0 112.193 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.57 167.94 9.47 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.393 0.677 . . . . 0.0 110.399 -175.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 65.5 mt -93.89 136.43 25.49 Favored 'Isoleucine or valine' 0 C--O 1.23 0.063 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 69.7 mmm -85.27 130.66 50.91 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-O 119.719 -0.182 . . . . 0.0 110.685 175.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -77.77 27.82 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 124.807 3.671 . . . . 0.0 111.341 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -74.54 -143.41 0.86 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 123.955 0.788 . . . . 0.0 113.535 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -72.53 166.95 21.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.727 0.811 . . . . 0.0 111.366 -174.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -146.11 175.46 10.46 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.928 0.891 . . . . 0.0 110.8 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.539 ' CD1' ' HE3' ' A' ' 413' ' ' LYS . 32.3 p90 -141.28 -178.4 5.58 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.734 0.813 . . . . 0.0 108.847 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -73.82 177.18 45.01 Favored Glycine 0 CA--C 1.528 0.867 0 O-C-N 122.031 -0.418 . . . . 0.0 113.02 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 28.0 mt -140.94 168.61 19.37 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 124.24 1.016 . . . . 0.0 109.745 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -71.78 -31.22 66.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.325 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -120.57 18.47 12.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.768 0.427 . . . . 0.0 110.442 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.28 172.99 42.43 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.495 -0.753 . . . . 0.0 112.444 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 95.0 p -99.77 -16.61 18.04 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.99 136.97 52.98 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.25 0.477 . . . . 0.0 111.013 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 94.8 p -83.63 -0.5 50.84 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.113 0.965 . . . . 0.0 111.634 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.265 4.0 t80 -131.24 149.16 52.69 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -155.27 150.47 26.96 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -177.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.285 0.3 OUTLIER -129.89 140.94 50.88 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 178.149 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.48 7.52 10.1 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 39.3 t -65.34 -19.62 66.04 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.983 0.513 . . . . 0.0 111.764 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -113.91 2.26 15.01 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.126 0.57 . . . . 0.0 111.539 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.1 t -80.74 151.96 28.58 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.67 0.388 . . . . 0.0 111.349 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . 0.433 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 57.4 ttt180 -81.64 -13.41 57.97 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.705 0.402 . . . . 0.0 111.191 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -59.52 -23.53 62.89 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -57.35 113.1 1.61 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.25 0.62 . . . . 0.0 109.775 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -75.32 -29.73 60.11 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.31 64.7 m-85 -98.0 15.03 25.31 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 43.8 t -71.34 -18.36 62.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -132.65 151.36 78.01 Favored Pre-proline 0 C--O 1.233 0.216 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.26 -32.51 62.03 Favored 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.345 2.697 . . . . 0.0 112.667 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -78.68 -27.33 45.08 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.115 0.416 . . . . 0.0 110.496 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -74.44 -41.13 61.37 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 174.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -63.43 -17.06 62.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 122.35 -0.218 . . . . 0.0 111.386 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -87.16 -10.54 52.43 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -124.02 -10.17 7.66 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -63.83 155.67 29.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -152.61 146.26 25.05 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 44.7 mm -123.21 149.32 26.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 C-N-CA 123.505 0.722 . . . . 0.0 109.516 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -156.02 155.95 33.58 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.823 0.449 . . . . 0.0 109.852 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -59.8 156.94 31.67 Favored Pre-proline 0 CA--C 1.529 0.157 0 C-N-CA 122.917 0.487 . . . . 0.0 109.906 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -62.91 142.67 89.25 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.182 1.922 . . . . 0.0 108.905 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.6 t -154.5 167.07 31.28 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.915 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -83.68 -2.54 56.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.802 0.441 . . . . 0.0 110.718 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.33 140.13 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.059 0 C-N-CA 123.503 0.721 . . . . 0.0 112.403 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.9 mt -128.85 156.47 43.59 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.065 0.546 . . . . 0.0 110.118 176.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -115.65 150.23 37.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -137.46 154.98 49.82 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -151.57 166.83 29.97 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 102.959 -2.978 . . . . 0.0 102.959 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 56.55 57.53 4.78 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.003 -0.436 . . . . 0.0 111.663 -174.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -133.0 148.92 71.33 Favored Pre-proline 0 N--CA 1.454 -0.248 0 C-N-CA 122.427 0.291 . . . . 0.0 110.61 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.42 161.06 47.38 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.003 2.468 . . . . 0.0 110.917 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.61 -16.38 63.83 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.485 0.314 . . . . 0.0 111.008 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -100.44 12.18 37.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.404 0.682 . . . . 0.0 111.532 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.33 -18.22 23.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.706 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.1 m -55.07 -177.27 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.811 -1.09 . . . . 0.0 113.686 -166.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.706 ' H ' HG22 ' A' ' 510' ' ' THR . 23.4 pt-20 -23.09 -41.18 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -169.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.7 mt-10 -57.86 -47.22 83.35 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 173.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -88.04 -27.91 21.7 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 122.356 2.343 . . . . 0.0 106.296 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.33 -37.27 86.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -75.27 -42.23 55.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.65 -24.22 49.49 Favored 'General case' 0 CA--C 1.526 0.024 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.222 -177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.04 -41.7 52.45 Favored 'Isoleucine or valine' 0 C--N 1.337 0.052 0 CA-C-N 118.864 0.756 . . . . 0.0 109.984 176.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 99.7 m -65.98 -26.99 67.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.056 -0.403 . . . . 0.0 110.853 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -70.17 -41.31 73.93 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -71.35 -24.46 62.1 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -89.24 -5.96 57.21 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.313 0.245 . . . . 0.0 111.212 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 69.19 -7.45 3.35 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 123.702 0.668 . . . . 0.0 113.867 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.4 m -83.9 172.83 1.0 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-N 118.459 1.129 . . . . 0.0 113.33 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.8 152.05 32.53 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.292 1.037 . . . . 0.0 113.077 -174.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 47.3 mtm105 -95.59 149.92 36.75 Favored Pre-proline 0 CA--C 1.529 0.141 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.828 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -69.74 150.29 68.12 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.137 2.558 . . . . 0.0 110.658 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -92.19 -14.11 29.55 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.6 t -152.58 155.52 37.53 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.358 0.263 . . . . 0.0 110.716 176.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 61.0 t -145.3 145.68 20.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 123.688 0.795 . . . . 0.0 111.31 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -147.36 142.34 26.98 Favored 'General case' 0 CA--C 1.526 0.056 0 C-N-CA 123.894 0.877 . . . . 0.0 109.334 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.69 143.03 31.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 122.981 0.513 . . . . 0.0 111.218 -176.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.1 p90 -155.67 -178.31 7.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 69.9 m -131.42 177.69 7.3 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 110.858 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.95 -5.78 59.76 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.792 0.711 . . . . 0.0 112.689 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -93.22 -20.34 20.54 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-N 117.886 0.843 . . . . 0.0 111.167 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 36.9 t -164.45 155.27 15.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.23 0.612 . . . . 0.0 110.432 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.98 -7.93 31.82 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.463 0.305 . . . . 0.0 110.517 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -89.23 -31.52 17.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.5 p -160.83 168.53 24.52 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.458 0.646 . . . . 0.0 112.287 -172.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 29.8 t -81.36 167.22 19.71 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.611 1.164 . . . . 0.0 111.379 178.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -146.72 159.74 43.1 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 124.373 1.069 . . . . 0.0 109.518 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.99 -173.82 45.7 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.84 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -119.27 159.76 23.48 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.413 0.685 . . . . 0.0 110.693 -177.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.7 mt -140.61 159.26 42.58 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.081 1.352 . . . . 0.0 108.414 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.99 149.1 29.18 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.979 -0.451 . . . . 0.0 111.183 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -124.04 171.0 10.1 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 125.027 1.331 . . . . 0.0 112.479 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -73.63 -12.66 60.81 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 122.803 0.441 . . . . 0.0 111.487 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.7 t -157.19 160.15 38.43 Favored 'General case' 0 C--N 1.339 0.115 0 O-C-N 121.687 -0.633 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.84 -29.89 68.31 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 122.201 0.2 . . . . 0.0 110.822 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 89.7 p -76.4 -26.01 55.14 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -74.85 -35.42 62.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.336 0.255 . . . . 0.0 110.932 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -73.04 -37.18 66.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.17 -37.66 78.3 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.236 -0.29 . . . . 0.0 110.247 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -62.0 -45.71 92.42 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.093 0.473 . . . . 0.0 110.264 176.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.6 m -69.9 -28.18 65.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.09 -35.7 81.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.14 -44.82 90.36 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.464 -0.631 . . . . 0.0 111.888 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -89.65 -24.6 21.6 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.33 -18.62 20.63 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -173.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.38 152.36 39.56 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.621 -0.674 . . . . 0.0 110.428 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.49 17.28 4.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.023 1.329 . . . . 0.0 113.182 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -69.75 139.3 53.31 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -75.85 138.9 41.41 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.863 -0.523 . . . . 0.0 111.945 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.3 mtm -83.49 152.66 24.82 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.125 0.488 . . . . 0.0 111.624 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 25.61 2.48 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.175 0.99 . . . . 0.0 113.062 -178.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 -56.24 112.21 4.12 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 118.279 0.49 . . . . 0.0 111.704 -177.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -82.35 -18.9 6.88 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.482 2.788 . . . . 0.0 112.123 -177.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -83.95 -12.82 54.78 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -96.28 156.09 21.16 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.588 -0.605 . . . . 0.0 111.588 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -70.68 -22.71 27.51 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 124.177 3.251 . . . . 0.0 110.583 176.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -153.13 156.27 32.51 Favored Pre-proline 0 N--CA 1.453 -0.297 0 C-N-CA 124.712 1.205 . . . . 0.0 113.933 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 159.77 52.18 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.601 2.201 . . . . 0.0 111.348 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . 0.421 ' CE2' ' C5 ' ' C' ' 1' ' ' ' A' . 6.0 m-85 -129.39 142.29 50.84 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 102.542 -3.133 . . . . 0.0 102.542 176.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.276 0.7 OUTLIER -78.15 138.53 38.76 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -176.029 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.47 150.79 25.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.977 1.311 . . . . 0.0 108.203 172.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.06 152.78 46.47 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.986 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 10.8 mt -132.27 164.91 25.37 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.822 0.849 . . . . 0.0 111.144 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 47.6 t -159.17 154.42 25.42 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.742 0.817 . . . . 0.0 109.21 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -59.93 117.06 4.61 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 174.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.487 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 40.3 t -73.0 146.95 45.6 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -169.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -112.32 10.82 19.99 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 169.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.3 162.54 17.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.619 0.768 . . . . 0.0 111.321 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -86.17 -3.8 59.04 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.727 -175.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -176.24 178.07 1.44 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.674 1.19 . . . . 0.0 109.576 178.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -133.23 16.62 4.1 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.866 0.467 . . . . 0.0 111.682 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.261 179.718 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.402 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.763 0 O4'-C1'-N19 111.863 3.663 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.447 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.873 0 C5'-C4'-C3' 110.841 -3.106 . 0.317 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.54 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C3'-C2'-C1' 104.972 3.857 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . 0.663 " H3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.925 1 P-O3'-C3' 125.367 4.722 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.891 1 O4'-C1'-N19 112.34 4.14 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.559 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.897 0 C3'-C2'-C1' 104.844 3.715 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.433 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C5'-C4'-C3' 110.717 -3.189 . 0.01 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.981 0 C3'-C2'-C1' 104.772 3.635 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.487 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 O4'-C1'-N19 111.8 3.6 . 0.177 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 1 C5'-C4'-C3' 107.654 -5.231 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.306 37.1 t80 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 159.63 170.69 24.51 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -60.1 159.06 27.42 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 124.042 3.161 . . . . 0.0 111.598 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -155.9 153.68 30.04 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.027 0.442 . . . . 0.0 111.09 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -78.22 163.4 25.81 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.142 0.577 . . . . 0.0 111.185 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -74.09 -7.11 51.37 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.6 t -159.05 148.26 14.55 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.495 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.61 -14.56 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 123.349 2.7 . . . . 0.0 110.737 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.61 149.84 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -137.24 152.95 50.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.792 1.237 . . . . 0.0 108.225 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -133.96 133.44 41.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.398 -0.189 . . . . 0.0 110.512 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -129.91 152.04 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.086 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.509 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 4.8 m-85 -140.74 173.13 11.79 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 -177.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.72 10.71 78.69 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.437 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 51.6 mt -80.69 25.13 0.44 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.464 0.705 . . . . 0.0 112.201 -178.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -65.38 -39.87 92.78 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -175.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.6 pm0 -67.28 149.66 50.08 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.133 0.492 . . . . 0.0 111.143 -178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 88.0 p -68.26 -8.63 41.07 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -77.71 -20.37 53.67 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 118.116 0.416 . . . . 0.0 111.182 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 64.9 mmm -82.06 147.87 28.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 122.178 -0.326 . . . . 0.0 110.252 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.07 155.78 25.8 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -60.71 -30.5 70.0 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -71.81 -40.03 69.44 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 61.0 mtt85 -76.05 -41.12 51.72 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 -175.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.58 -43.66 77.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -176.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -76.83 -29.54 55.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.429 -0.796 . . . . 0.0 109.198 -169.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -78.84 -30.21 45.08 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 119.991 1.269 . . . . 0.0 110.0 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -54.77 29.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.557 2.4 p90 -76.72 -7.34 55.17 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 172.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 53.7 t -69.28 -26.39 64.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 78.8 mt -54.4 -24.36 19.48 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -92.94 -11.07 34.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -173.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 170.68 176.87 40.32 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 118.205 0.457 . . . . 0.0 112.199 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -68.61 136.28 52.77 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.853 0.359 . . . . 0.0 111.683 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.06 165.52 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -119.97 -70.96 0.76 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.449 0.3 . . . . 0.0 111.238 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -154.44 170.68 20.81 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 9.2 p -146.03 149.37 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.369 1.068 . . . . 0.0 110.513 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -155.8 137.86 14.58 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.353 0.661 . . . . 0.0 111.075 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.4 m-85 -88.23 156.53 19.17 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 21.9 mmt -98.38 118.86 36.0 Favored 'General case' 0 N--CA 1.457 -0.078 0 C-N-CA 122.879 0.472 . . . . 0.0 111.882 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.2 -14.42 59.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.148 0.179 . . . . 0.0 110.686 169.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 98.9 p -84.23 1.3 45.25 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.752 0.821 . . . . 0.0 112.377 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.436 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 47.4 mmtm -139.38 155.66 72.03 Favored Pre-proline 0 CA--C 1.528 0.115 0 C-N-CA 123.665 0.786 . . . . 0.0 110.134 -177.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -68.34 -16.08 43.15 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.174 2.583 . . . . 0.0 111.647 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.77 93.77 0.09 OUTLIER Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.41 161.55 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.467 0.707 . . . . 0.0 109.329 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.49 151.25 25.91 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.129 0.49 . . . . 0.0 111.958 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 36.8 ttm -96.11 147.29 23.88 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.6 t -141.17 152.46 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -138.56 133.69 32.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 42.6 mtp -152.36 174.17 14.16 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.346 1.058 . . . . 0.0 109.053 -171.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.85 124.25 21.97 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -72.53 -32.26 65.96 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 120.744 -1.222 . . . . 0.0 114.164 -166.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.07 -90.84 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 O-C-N 124.559 1.162 . . . . 0.0 110.775 -176.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.296 64.7 m-85 -75.85 -20.24 58.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -177.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.2 -33.99 15.98 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 118.569 -1.253 . . . . 0.0 111.371 -175.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.6 t -86.97 -26.96 5.89 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 C-N-CA 118.238 -1.385 . . . . 0.0 109.057 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -67.5 -51.37 52.0 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.651 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -65.49 -35.83 82.06 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.965 -0.46 . . . . 0.0 112.111 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.29 83.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.604 0.638 . . . . 0.0 110.417 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.5 mt -77.13 -14.15 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 122.848 0.459 . . . . 0.0 110.899 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 15.5 m -94.7 -19.78 20.11 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 114.452 1.279 . . . . 0.0 114.452 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -126.07 -27.99 3.21 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.9 mt -134.38 -8.94 2.55 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -172.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.635 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -70.27 105.32 2.94 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -168.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 15.3 m-80 75.15 22.08 1.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 116.788 -3.695 . . . . 0.0 115.055 -164.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -77.36 161.45 28.03 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.307 -0.871 . . . . 0.0 109.707 167.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -79.62 138.37 37.4 Favored 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 177.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.2 ttt -159.51 136.95 9.83 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.289 0.636 . . . . 0.0 110.174 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.389 52.0 m-85 57.32 26.65 12.66 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.02 9.79 86.69 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.261 -0.735 . . . . 0.0 111.261 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -135.84 -164.67 1.58 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.019 1.328 . . . . 0.0 108.779 -178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.46 147.22 52.13 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.698 0.285 . . . . 0.0 111.33 -176.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.5 ptm -118.57 75.6 1.03 Allowed 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 124.477 1.111 . . . . 0.0 109.171 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.3 m120 -53.7 127.19 24.71 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 115.979 -1.963 . . . . 0.0 112.265 -173.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.635 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.431 2.2 t -126.71 152.06 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 113.537 -3.265 . . . . 0.0 115.877 169.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 43.2 t -160.74 165.74 29.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.523 1.529 . . . . 0.0 108.324 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.14 147.93 11.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 O-C-N 121.56 -0.713 . . . . 0.0 112.56 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.4 t -88.14 157.72 18.75 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 122.827 0.451 . . . . 0.0 111.35 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -97.55 -5.66 35.26 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.087 0.155 . . . . 0.0 110.652 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -77.84 152.57 80.2 Favored Pre-proline 0 N--CA 1.456 -0.153 0 C-N-CA 123.546 0.739 . . . . 0.0 111.029 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.56 -36.06 0.97 Allowed 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.363 2.709 . . . . 0.0 112.139 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.99 159.69 9.5 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.358 0.663 . . . . 0.0 110.707 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.23 132.41 32.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 37.0 mmm -100.33 126.24 36.76 Favored Pre-proline 0 N--CA 1.454 -0.24 0 C-N-CA 122.454 0.301 . . . . 0.0 110.707 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.62 153.79 44.03 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.186 2.591 . . . . 0.0 109.102 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 167.81 -127.8 1.62 Allowed Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.86 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -72.45 172.95 9.51 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 94.1 p -156.36 172.3 18.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.044 0.538 . . . . 0.0 110.215 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -137.16 4.44 2.7 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.0 -176.2 53.93 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 56.0 mt -145.65 168.76 19.9 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.053 0.941 . . . . 0.0 109.916 -178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.4 pm0 -65.3 -31.38 72.49 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.065 0.546 . . . . 0.0 110.364 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -120.5 10.02 11.04 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.47 172.82 30.94 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.739 -0.545 . . . . 0.0 111.739 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 92.0 p -101.72 -15.03 17.11 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 122.89 0.476 . . . . 0.0 111.997 -176.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.11 145.69 50.65 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.864 0.465 . . . . 0.0 110.171 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 78.6 p -85.49 10.4 13.1 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.396 0.678 . . . . 0.0 111.301 177.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -138.18 149.9 46.26 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -152.29 150.98 30.35 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 120.801 0.334 . . . . 0.0 110.485 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -124.09 138.37 54.44 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.156 0.983 . . . . 0.0 113.577 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.23 2.53 5.18 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 95.9 p -66.11 -15.91 63.5 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.123 0.569 . . . . 0.0 112.158 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -113.98 -0.38 14.1 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.05 0.54 . . . . 0.0 111.369 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 68.6 m -79.84 150.83 30.54 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.599 0.36 . . . . 0.0 111.522 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -79.47 -12.56 59.88 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.987 0.515 . . . . 0.0 111.193 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.18 -18.99 62.62 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -176.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -61.75 115.04 3.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -73.06 -31.52 64.45 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.447 0.299 . . . . 0.0 111.59 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.29 61.1 m-85 -97.93 17.4 18.31 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 42.6 t -64.43 -20.9 66.45 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 0.8 OUTLIER -137.86 151.39 70.28 Favored Pre-proline 0 C--O 1.231 0.129 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -178.386 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.3 Cg_endo -70.55 -23.59 27.01 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.111 2.541 . . . . 0.0 111.923 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -80.13 -20.15 45.61 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.255 0.48 . . . . 0.0 110.705 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -85.73 -39.7 16.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 172.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.67 -19.96 64.36 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.761 0.424 . . . . 0.0 111.996 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.27 -21.36 53.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -124.08 7.74 8.59 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.03 156.63 38.32 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.453 0.57 . . . . 0.0 111.913 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.419 ' NH2' " H2'" ' C' ' 4' ' ' ' C' . 10.6 mpt_? -118.6 146.47 44.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.553 0.741 . . . . 0.0 110.728 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 34.3 mm -143.57 138.29 25.64 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.21 159.3 35.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -58.81 154.91 34.24 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -65.16 146.57 87.04 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 122.32 2.013 . . . . 0.0 109.073 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -155.95 170.95 20.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.309 0.244 . . . . 0.0 110.636 -173.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -83.7 -1.19 53.56 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.569 0.348 . . . . 0.0 111.034 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.77 137.57 29.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.108 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 67.5 mt -123.32 161.48 24.58 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.232 0.613 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -130.17 143.76 50.97 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.736 1.214 . . . . 0.0 108.316 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.86 163.24 30.69 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.445 0.64 . . . . 0.0 112.067 -177.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -149.31 162.53 39.88 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 57.1 57.36 4.61 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.736 0.414 . . . . 0.0 111.727 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -121.64 151.27 56.82 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 122.686 0.394 . . . . 0.0 111.989 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.84 152.61 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.585 2.857 . . . . 0.0 112.921 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.61 -16.43 63.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.173 0.589 . . . . 0.0 111.444 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -123.05 25.62 8.44 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.394 0.677 . . . . 0.0 110.696 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.79 -12.59 14.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.657 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.91 -177.31 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.865 -1.065 . . . . 0.0 113.854 -165.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.657 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -26.46 -37.27 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -169.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.3 mt-10 -58.22 -47.38 83.69 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 117.07 -1.443 . . . . 0.0 114.559 171.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -88.19 -26.7 22.26 Favored 'General case' 0 C--N 1.353 0.718 0 CA-C-N 122.732 2.514 . . . . 0.0 107.113 -173.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -67.63 -34.49 77.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.503 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -75.2 -42.86 54.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -76.19 -21.34 56.58 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.802 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.96 -40.6 26.86 Favored 'Isoleucine or valine' 0 C--N 1.339 0.113 0 CA-C-N 118.423 0.556 . . . . 0.0 109.954 175.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 87.7 m -68.4 -34.59 76.31 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.958 -0.464 . . . . 0.0 110.933 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.16 -38.1 84.88 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -70.54 -28.39 64.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 122.114 -0.366 . . . . 0.0 111.032 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -92.51 -4.12 54.07 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.263 0.625 . . . . 0.0 111.519 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.58 -2.0 59.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.15 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 3.0 t -77.1 153.55 5.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 118.072 0.936 . . . . 0.0 112.182 178.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -68.36 151.68 46.52 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 122.061 -0.399 . . . . 0.0 110.294 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.9 ptt85 -78.07 156.14 79.56 Favored Pre-proline 0 CA--C 1.53 0.2 0 C-N-CA 122.685 0.394 . . . . 0.0 110.365 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.06 154.29 72.93 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.111 2.541 . . . . 0.0 110.386 173.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.3 t -85.39 -17.28 37.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.1 t -156.97 152.72 27.0 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.558 0.343 . . . . 0.0 110.173 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.1 m -143.44 154.73 16.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 123.719 0.808 . . . . 0.0 112.35 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -150.75 144.33 25.05 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.181 0.592 . . . . 0.0 109.973 176.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -138.08 150.73 24.85 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 C-N-CA 123.398 0.679 . . . . 0.0 112.218 177.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -152.83 174.84 13.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.7 t -142.96 168.91 18.59 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.556 0.742 . . . . 0.0 109.624 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 115.15 -16.47 17.74 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 123.857 0.741 . . . . 0.0 111.985 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -80.91 -26.48 36.74 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 117.795 0.797 . . . . 0.0 111.131 175.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.2 t -163.9 157.35 18.58 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.747 0.819 . . . . 0.0 109.686 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -96.99 -6.89 34.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.539 0.336 . . . . 0.0 110.532 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -78.18 -41.54 34.33 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 32.5 t -161.13 163.56 31.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -170.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -90.36 167.32 12.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.096 0.958 . . . . 0.0 111.702 -177.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.3 m -145.44 165.66 27.91 Favored 'General case' 0 CA--C 1.527 0.069 0 C-N-CA 124.996 1.318 . . . . 0.0 108.748 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 173.69 -170.77 43.92 Favored Glycine 0 CA--C 1.525 0.701 0 C-N-CA 120.554 -0.832 . . . . 0.0 113.322 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -122.03 159.84 26.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.036 0.934 . . . . 0.0 110.228 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.9 mt -141.51 156.91 45.7 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 124.588 1.155 . . . . 0.0 109.085 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -148.18 149.38 31.87 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 117.925 0.33 . . . . 0.0 111.664 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.0 m-90 -126.81 172.53 10.3 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 124.828 1.251 . . . . 0.0 112.152 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -76.13 -9.59 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.666 0.386 . . . . 0.0 110.556 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 29.9 t -158.4 158.93 35.15 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.623 -0.673 . . . . 0.0 111.669 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -69.45 -24.9 63.87 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 122.368 0.267 . . . . 0.0 110.502 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 49.2 m -77.91 -27.49 49.53 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -74.31 -32.15 62.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -77.83 -25.91 49.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.7 tp -77.38 -37.16 52.66 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.199 0.199 . . . . 0.0 111.317 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -75.61 -38.54 58.92 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.591 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.264 0.2 OUTLIER -71.6 -22.28 61.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 12.1 tp -67.91 -37.44 81.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 170.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.11 -30.46 76.93 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.315 11.5 m-85 -101.32 -2.57 30.72 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 84.6 mt -125.05 -3.63 7.56 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.287 0.948 . . . . 0.0 113.29 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -79.88 139.58 37.08 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.739 1.154 . . . . 0.0 109.586 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 56.74 19.37 4.32 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 175.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -77.86 149.96 34.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 104.103 -2.555 . . . . 0.0 104.103 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -78.34 143.38 36.96 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.719 0.408 . . . . 0.0 111.992 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.1 mtm -83.57 152.65 24.75 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 111.259 175.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -81.33 38.67 0.49 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.138 0.975 . . . . 0.0 111.295 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -47.0 109.94 1.17 Allowed Pre-proline 0 CA--C 1.533 0.297 0 C-N-CA 123.893 0.877 . . . . 0.0 112.734 -171.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -86.42 -12.93 5.36 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.824 3.016 . . . . 0.0 111.682 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -84.48 -0.17 51.94 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -173.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -159.78 170.21 35.92 Favored Glycine 0 CA--C 1.526 0.772 0 CA-C-N 118.31 0.505 . . . . 0.0 112.327 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.2 -10.73 24.56 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.952 3.768 . . . . 0.0 112.232 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.254 0.8 OUTLIER -140.6 149.38 56.82 Favored Pre-proline 0 N--CA 1.454 -0.267 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -77.58 164.22 28.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 123.751 2.967 . . . . 0.0 111.675 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -129.93 142.29 50.67 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 172.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.02 141.96 32.76 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 8.2 tt -82.3 146.1 29.61 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 172.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.14 148.48 49.76 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 117.829 0.286 . . . . 0.0 110.237 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.3 pp -154.99 165.46 36.68 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.181 0.515 . . . . 0.0 111.811 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 31.3 p -159.8 174.42 14.51 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.971 0.908 . . . . 0.0 109.887 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -61.04 126.43 27.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 35.4 t -84.29 156.09 22.11 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -172.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -122.08 11.78 10.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.317 1.047 . . . . 0.0 113.604 170.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.58 162.92 14.59 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.087 0.955 . . . . 0.0 111.659 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -85.73 -3.23 58.84 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.65 178.21 3.18 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.027 0.931 . . . . 0.0 109.359 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -132.41 16.43 4.47 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.987 0.515 . . . . 0.0 111.465 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.614 -1.184 . . . . 0.0 110.492 -179.861 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.509 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.762 1 O4'-C1'-N19 112.236 4.036 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 0 C5'-C4'-C3' 110.314 -3.457 . 0.373 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.567 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.944 0 C3'-C2'-C1' 104.557 3.397 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.789 1 C5'-C4'-C3' 108.971 -4.353 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.898 1 O4'-C1'-N19 112.754 4.554 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.5 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.752 0 C5'-C4'-C3' 109.632 -3.912 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C5'-C4'-C3' 111.441 -2.706 . 0.08 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.926 0 C3'-C2'-C1' 104.645 3.495 . 0.055 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.419 " H2'" ' NH2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 O4'-C1'-N19 111.657 3.457 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.629 1 C5'-C4'-C3' 108.397 -4.735 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.303 35.7 t80 . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -73.73 167.81 54.29 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.31 176.79 6.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.369 3.38 . . . . 0.0 110.816 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -146.33 158.32 43.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.819 0.448 . . . . 0.0 110.539 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.41 160.65 31.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.623 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -78.95 -3.43 44.89 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.379 0.672 . . . . 0.0 110.576 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -155.12 148.64 18.61 Favored Pre-proline 0 C--O 1.233 0.21 0 O-C-N 121.726 -0.609 . . . . 0.0 112.058 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -61.33 -5.84 5.89 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 124.246 3.297 . . . . 0.0 113.029 172.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 153.33 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.091 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.7 tt -128.07 154.49 45.64 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.655 1.582 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.9 tpt -137.4 133.55 34.9 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 117.847 0.294 . . . . 0.0 110.971 -175.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.54 153.44 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 109.119 -0.696 . . . . 0.0 109.119 -175.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.502 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 2.5 m-85 -146.12 170.48 16.61 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 87.72 6.94 75.83 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.669 -0.517 . . . . 0.0 113.07 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.05 45.28 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.106 0.962 . . . . 0.0 111.372 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -82.04 -13.47 57.29 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -174.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -83.76 147.14 27.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.672 0.389 . . . . 0.0 110.176 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 91.1 p -72.67 -7.32 49.81 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -81.47 -17.4 48.85 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.651 0.38 . . . . 0.0 111.353 -177.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 92.5 mmm -83.66 162.63 20.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.351 0.596 . . . . 0.0 111.487 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -167.74 168.76 12.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.612 1.565 . . . . 0.0 106.79 176.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 26.2 p -61.67 -34.25 75.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.379 0.536 . . . . 0.0 110.95 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -74.74 -29.51 61.19 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -74.23 -51.54 15.09 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 122.127 -0.358 . . . . 0.0 111.052 -175.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.7 p -72.6 -37.61 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -73.37 -32.06 64.29 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.13 -48.37 80.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 118.897 0.771 . . . . 0.0 111.403 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 31.0 t -56.69 -55.63 18.63 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.537 1.4 p90 -76.52 -5.8 49.11 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 29.0 t -77.4 -34.05 54.9 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.699 -0.626 . . . . 0.0 111.657 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . 0.478 HD12 ' C ' ' A' ' 402' ' ' LEU . 2.7 pp -62.66 -12.23 22.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 119.916 -0.714 . . . . 0.0 111.597 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.81 2.77 40.8 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 169.94 -144.38 8.48 Favored Glycine 0 CA--C 1.525 0.688 0 O-C-N 121.805 -0.559 . . . . 0.0 112.008 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -116.17 131.65 56.88 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.9 m -113.94 165.59 8.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -175.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -118.42 -65.95 1.12 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.563 0.345 . . . . 0.0 111.662 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . 0.458 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 36.2 mtmm -150.57 169.3 21.87 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.325 0.511 . . . . 0.0 111.914 -173.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.9 p -146.78 147.83 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 123.95 0.9 . . . . 0.0 109.264 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -154.63 140.74 18.44 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.582 0.353 . . . . 0.0 111.118 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.281 5.2 m-85 -94.44 156.52 16.44 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 117.052 2.242 . . . . 0.0 117.052 -178.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.4 mmt -93.75 125.17 38.22 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.008 0.523 . . . . 0.0 112.234 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.432 ' HE2' " O3'" ' B' ' 3' ' ' ' A' . 0.2 OUTLIER -79.12 -14.32 59.2 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 124.311 1.044 . . . . 0.0 111.802 176.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 90.4 p -97.18 1.25 49.59 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.364 0.666 . . . . 0.0 112.483 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.447 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 46.7 mmtm -131.44 152.81 81.15 Favored Pre-proline 0 CA--C 1.53 0.196 0 C-N-CA 123.165 0.586 . . . . 0.0 110.293 -175.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -71.07 -14.68 32.08 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.303 2.669 . . . . 0.0 111.737 179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.21 90.81 0.08 OUTLIER Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.63 156.23 37.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.91 154.01 29.06 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.945 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.2 ptm -107.64 150.01 27.4 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 9.4 t -141.18 130.33 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -173.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -107.18 131.93 53.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 47.6 mtp -153.29 171.29 18.79 Favored 'General case' 0 C--O 1.231 0.092 0 C-N-CA 123.211 0.605 . . . . 0.0 109.377 -172.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.79 115.89 6.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 169.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -72.35 -33.44 67.27 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.78 -87.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -75.07 -25.56 58.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -175.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.35 -36.09 16.8 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.053 -174.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.57 -26.45 6.5 Favored 'Isoleucine or valine' 0 C--N 1.342 0.273 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.042 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -64.43 -53.4 49.01 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 117.981 0.355 . . . . 0.0 111.947 173.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -69.91 -29.18 66.29 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.01 80.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.599 0.636 . . . . 0.0 110.144 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 61.0 mt -78.6 -15.44 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.147 0.579 . . . . 0.0 110.73 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 45.3 m -91.37 -20.82 21.42 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.453 ' C ' HD22 ' A' ' 436' ' ' LEU . 97.1 m-70 -132.55 -24.35 2.01 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -169.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.453 HD22 ' C ' ' A' ' 435' ' ' HIS . 4.1 mm? -128.91 -12.14 4.75 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.731 1.605 . . . . 0.0 113.78 -172.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.606 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.79 101.07 2.51 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -168.468 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.56 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 17.3 m-80 78.85 21.82 0.69 Allowed 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 123.643 2.928 . . . . 0.0 113.639 -160.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -81.09 157.85 25.24 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.469 -0.769 . . . . 0.0 109.073 167.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -78.58 139.05 38.64 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.9 ttt -154.17 133.96 12.98 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . 0.404 ' CZ ' ' CD1' ' A' ' 558' ' ' PHE 0.356 53.5 m-85 56.69 22.6 6.98 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 -176.509 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 88.81 11.03 66.19 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 119.846 -0.419 . . . . 0.0 112.741 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -146.38 146.4 30.62 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 117.775 0.788 . . . . 0.0 111.002 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -77.61 149.95 34.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.996 0.518 . . . . 0.0 111.361 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.1 ptt? -131.48 83.67 2.12 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.494 0.717 . . . . 0.0 109.281 176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.56 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 28.9 t-20 -54.66 129.26 35.96 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.163 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.606 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.461 2.1 t -123.79 150.61 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 113.118 -3.433 . . . . 0.0 115.953 168.417 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 33.8 t -160.82 172.01 17.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.538 1.135 . . . . 0.0 108.211 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.3 p -73.23 147.19 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.6 t -86.78 155.68 20.22 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.226 0.61 . . . . 0.0 111.491 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -92.88 -7.53 45.96 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -77.58 145.7 71.91 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.049 0.94 . . . . 0.0 110.34 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.7 -33.87 2.11 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.019 2.48 . . . . 0.0 111.388 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.91 161.66 10.89 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.458 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 64.5 mt -83.61 129.03 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 mmm -91.93 122.41 65.29 Favored Pre-proline 0 N--CA 1.454 -0.257 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 174.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.81 144.02 47.35 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 122.665 2.243 . . . . 0.0 108.827 174.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 169.69 -134.56 3.22 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.582 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -72.55 160.9 31.52 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.371 0.669 . . . . 0.0 111.369 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 88.3 p -145.03 171.94 13.77 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.461 1.104 . . . . 0.0 109.546 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -133.65 -0.49 3.18 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.35 179.78 51.14 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 112.172 -0.371 . . . . 0.0 112.172 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 81.9 mt -143.37 154.19 43.48 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 123.864 0.866 . . . . 0.0 109.25 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -75.26 -4.08 36.97 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.447 0.299 . . . . 0.0 110.98 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -120.43 11.11 11.34 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.223 1.009 . . . . 0.0 113.698 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -163.74 -144.84 4.17 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.056 -1.218 . . . . 0.0 110.056 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 97.6 p -133.0 -24.52 1.89 Allowed 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.269 0.534 . . . . 0.0 112.138 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.2 t -127.06 149.73 49.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.754 0.421 . . . . 0.0 110.286 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.2 p -91.7 9.89 30.57 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.28 0.632 . . . . 0.0 110.856 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -143.92 150.9 39.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -155.22 157.68 37.7 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.606 0.241 . . . . 0.0 110.363 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -133.31 133.69 42.88 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -176.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.64 1.43 9.46 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.7 p -72.86 -6.91 48.15 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.545 0.738 . . . . 0.0 111.314 -179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -113.95 16.79 18.23 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.885 0.874 . . . . 0.0 111.528 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.4 t -139.03 150.92 46.35 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.87 6.48 41.69 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.909 0.884 . . . . 0.0 112.185 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -63.5 -25.72 68.39 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -67.32 150.37 49.1 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -69.9 -33.78 72.65 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.337 -0.545 . . . . 0.0 112.071 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.418 56.6 m-85 -98.08 10.19 41.04 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 177.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.4 t -69.24 -21.66 63.91 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -171.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' A' ' 485' ' ' PRO . 1.1 p -133.3 150.86 76.4 Favored Pre-proline 0 CA--C 1.529 0.145 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -175.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 484' ' ' THR . 72.8 Cg_endo -70.53 -23.5 27.22 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.168 2.579 . . . . 0.0 112.0 -177.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -73.76 -24.11 59.82 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.452 0.569 . . . . 0.0 110.217 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -83.21 -52.72 6.34 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 174.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.25 -20.39 64.19 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.762 0.825 . . . . 0.0 112.622 -171.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.51 60.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 117.943 0.338 . . . . 0.0 111.634 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -124.03 6.65 8.59 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.61 155.44 15.52 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.492 0.587 . . . . 0.0 112.233 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.405 ' HD2' ' C6 ' ' C' ' 4' ' ' ' C' . 13.4 ptp180 -152.98 147.23 25.69 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.0 mm -136.61 151.45 28.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 C-N-CA 123.379 0.671 . . . . 0.0 109.734 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -155.99 158.02 37.17 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -61.84 154.94 64.92 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -62.39 144.06 94.44 Favored 'Trans proline' 0 N--CA 1.449 -1.096 0 C-N-CA 122.811 2.341 . . . . 0.0 109.909 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 39.9 t -153.45 -179.99 8.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -174.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -83.73 0.01 48.98 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.989 -0.444 . . . . 0.0 110.802 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.0 t -100.18 137.24 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.3 mt -125.59 159.81 31.19 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.668 0.787 . . . . 0.0 109.134 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -128.81 147.03 50.76 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -133.52 159.89 39.07 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -150.62 163.57 38.19 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 56.93 43.49 24.63 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.154 -0.341 . . . . 0.0 111.537 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -105.52 150.8 39.44 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.13 153.46 32.71 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 123.448 2.765 . . . . 0.0 112.673 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 507' ' ' LEU . 3.7 mm? -68.55 -16.52 63.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.079 0.552 . . . . 0.0 111.581 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -122.95 24.07 9.11 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.514 0.726 . . . . 0.0 110.98 -177.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.8 p -64.29 -13.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.665 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.4 OUTLIER -54.76 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -165.836 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -25.55 -37.15 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -169.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.1 mt-10 -58.37 -48.69 79.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 117.244 -1.36 . . . . 0.0 114.22 171.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -86.21 -27.16 24.67 Favored 'General case' 0 C--N 1.352 0.68 0 CA-C-N 122.407 2.367 . . . . 0.0 106.747 -173.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -64.57 -39.81 94.41 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -71.97 -42.45 66.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.35 -26.85 56.15 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.042 -1.063 . . . . 0.0 111.155 -177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 49.9 mt -70.55 -39.61 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 CA-C-N 118.825 0.739 . . . . 0.0 110.456 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.4 m -66.04 -34.16 77.45 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.012 -0.43 . . . . 0.0 110.786 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -70.77 -27.19 63.74 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -80.53 -8.55 59.62 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.354 0.261 . . . . 0.0 111.618 177.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.4 mt -114.91 -2.88 12.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.738 0.415 . . . . 0.0 111.578 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.28 0.35 56.96 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 119.78 -0.455 . . . . 0.0 112.271 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.0 148.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 CA-C-N 117.778 0.789 . . . . 0.0 110.851 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -69.55 145.5 52.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 120.89 0.376 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 -71.26 150.68 94.4 Favored Pre-proline 0 N--CA 1.455 -0.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.412 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.2 158.73 56.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 123.841 3.028 . . . . 0.0 111.095 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -90.9 -23.13 20.59 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.6 m -154.13 152.16 30.1 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.979 0.511 . . . . 0.0 111.119 176.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.04 156.56 19.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.76 0.824 . . . . 0.0 112.993 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -153.67 143.25 21.73 Favored 'General case' 0 C--O 1.228 -0.046 0 C-N-CA 122.918 0.487 . . . . 0.0 109.824 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.29 149.33 25.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.498 0.719 . . . . 0.0 112.207 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -156.45 -171.52 3.73 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.3 t -140.68 -176.65 4.73 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.872 0.869 . . . . 0.0 109.948 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.8 74.44 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.847 0.737 . . . . 0.0 111.967 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -96.36 -17.03 20.94 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 117.429 0.614 . . . . 0.0 111.279 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 48.3 t -164.05 151.55 12.27 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.3 0.64 . . . . 0.0 110.082 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.06 -7.77 31.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.667 0.387 . . . . 0.0 110.546 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -86.68 -33.72 19.97 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.603 0.761 . . . . 0.0 112.465 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 96.4 p -162.89 173.37 13.79 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.076 0.465 . . . . 0.0 111.48 -169.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.4 t -88.31 166.69 14.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.485 0.714 . . . . 0.0 110.934 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.1 p -149.69 162.86 39.39 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 124.382 1.073 . . . . 0.0 108.427 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 174.44 -172.79 45.67 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.572 -177.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -113.3 159.45 19.36 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.595 0.758 . . . . 0.0 110.321 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 15.0 tp -145.64 152.19 39.25 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.963 0.905 . . . . 0.0 108.726 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -150.44 148.65 29.01 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-N 119.197 0.908 . . . . 0.0 112.921 -174.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -123.47 175.73 6.6 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 125.245 1.418 . . . . 0.0 112.802 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.61 -5.38 57.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 40.7 t -158.31 155.73 29.35 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.195 0.598 . . . . 0.0 110.61 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -72.67 -24.21 60.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.521 0.328 . . . . 0.0 111.12 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.8 p -79.16 -24.12 43.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.931 0.332 . . . . 0.0 110.442 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -76.99 -31.6 56.6 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.424 0.29 . . . . 0.0 111.385 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.77 -28.04 58.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.34 -39.78 62.59 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.162 -0.336 . . . . 0.0 111.073 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -70.15 -36.77 74.97 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.483 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.3 m -69.79 -27.8 65.2 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 10.4 tp -62.87 -38.26 90.17 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -65.82 -38.32 94.25 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 442' ' ' PHE 0.298 8.0 m-85 -92.44 -3.0 55.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 119.214 3.042 . . . . 0.0 119.214 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 37.4 mt -133.92 -6.71 2.75 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -69.76 143.22 53.07 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 120.46 1.482 . . . . 0.0 108.991 176.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 60.49 18.94 8.72 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.119 0.968 . . . . 0.0 113.271 178.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 34.5 t80 -70.13 135.3 49.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.51 139.32 47.53 Favored 'General case' 0 C--O 1.23 0.069 0 O-C-N 122.001 -0.437 . . . . 0.0 112.168 -174.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.52 152.45 24.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.296 175.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 10.5 ptmm? -83.65 46.26 1.14 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.839 0.856 . . . . 0.0 110.624 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -49.72 110.3 1.56 Allowed Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 123.663 0.785 . . . . 0.0 112.129 -173.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.67 -14.19 5.56 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 123.65 2.9 . . . . 0.0 111.474 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -90.59 6.05 45.33 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -173.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -162.2 167.76 36.94 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 118.502 0.592 . . . . 0.0 112.356 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -73.99 -10.37 22.89 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 124.841 3.694 . . . . 0.0 112.07 -178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -140.18 148.54 54.81 Favored Pre-proline 0 N--CA 1.455 -0.188 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.91 164.26 25.31 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 124.005 3.137 . . . . 0.0 111.792 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -129.88 142.33 50.68 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 102.006 -3.331 . . . . 0.0 102.006 171.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.274 0.6 OUTLIER -81.95 137.15 35.21 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -174.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -78.11 135.1 37.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . 0.463 ' HE2' " H1'" ' C' ' 2' ' ' ' C' . 0.1 OUTLIER -128.49 151.19 49.7 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -178.703 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.2 pp -151.38 166.48 30.91 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.489 0.662 . . . . 0.0 110.962 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 402' ' ' LEU . 45.2 t -159.81 163.0 34.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.781 0.832 . . . . 0.0 109.359 -174.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -57.52 124.74 20.04 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 172.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.45 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 34.0 t -75.1 149.03 39.22 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -170.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.271 0.6 OUTLIER -116.86 9.67 13.92 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 170.788 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -68.05 163.39 22.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.204 1.002 . . . . 0.0 111.816 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -92.5 -3.05 55.74 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.513 -178.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -155.14 174.61 14.96 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 123.572 0.749 . . . . 0.0 110.491 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -143.44 18.78 1.88 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.045 0.938 . . . . 0.0 109.855 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.221 -1.371 . . . . 0.0 110.918 -177.414 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.502 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.701 1 O4'-C1'-N19 112.437 4.237 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.792 0 C5'-C4'-C3' 110.573 -3.284 . 0.453 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.432 " O3'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.949 1 C3'-C2'-C1' 105.521 4.468 OUTLIER-DELTA 0.199 4b . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . 0.481 ' C6 ' H5'' ' B' ' 4' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.928 1 C5'-C4'-C3' 108.525 -4.65 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . 0.431 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.754 1 O4'-C1'-N19 113.058 4.858 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.461 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 C3'-C2'-C1' 104.811 3.679 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.463 " H1'" ' HE2' ' A' ' 576' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.861 0 O4'-C1'-N19 111.055 2.855 . 0.084 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.923 0 C3'-C2'-C1' 104.466 3.296 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.45 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.709 0 O4'-C1'-N19 111.259 3.059 . 0.246 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.723 1 C5'-C4'-C3' 108.715 -4.523 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.28 22.1 t80 . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.75 174.76 46.88 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 111.289 -0.724 . . . . 0.0 111.289 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.9 167.05 25.73 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.308 3.339 . . . . 0.0 111.101 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -156.66 159.69 38.65 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.746 0.418 . . . . 0.0 110.721 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.15 163.26 28.22 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.781 0.433 . . . . 0.0 111.209 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -71.53 -9.59 58.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.77 148.4 12.49 Favored Pre-proline 0 CA--C 1.53 0.21 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.162 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.13 -18.73 45.55 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.554 2.836 . . . . 0.0 112.085 172.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 3.2 t -87.6 153.32 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.5 tt -143.08 154.04 43.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.246 1.018 . . . . 0.0 108.907 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . 0.481 ' HG3' ' C2 ' ' B' ' 2' ' ' ' C' . 77.3 mmm -132.01 141.73 49.35 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.62 0.368 . . . . 0.0 111.292 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.11 150.6 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.437 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 9.1 m-85 -141.36 173.45 11.48 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 -175.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.56 8.59 80.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.849 -0.5 . . . . 0.0 111.849 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 29.06 0.19 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.696 0.798 . . . . 0.0 112.248 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -64.14 -37.3 86.98 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 388' ' ' GLN . 8.3 pm0 -67.35 149.61 50.08 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 33.8 t -70.45 -9.75 57.32 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.301 0.64 . . . . 0.0 112.582 -175.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -71.4 -21.21 62.03 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 121.897 -0.502 . . . . 0.0 111.621 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 55.1 mmm -82.29 145.93 29.72 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 122.078 -0.389 . . . . 0.0 110.696 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -160.27 156.07 25.82 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.256 1.022 . . . . 0.0 108.452 177.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.8 p -59.99 -29.23 68.32 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -70.97 -42.44 69.72 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.201 0.455 . . . . 0.0 111.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -75.98 -42.7 47.47 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -175.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 27.5 t -69.45 -42.24 80.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.409 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 2.3 t80 -76.9 -32.88 57.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -169.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 0.418 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.5 p30 -74.17 -29.36 61.74 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 120.012 1.278 . . . . 0.0 109.897 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.3 t -59.67 -59.2 4.3 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.552 0.7 OUTLIER -76.65 -3.48 38.09 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 174.35 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 33.1 t -74.66 -37.77 62.63 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.873 -0.517 . . . . 0.0 111.323 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.37 -16.99 51.81 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -9.81 59.75 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 117.118 2.266 . . . . 0.0 117.118 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -174.03 -128.99 1.13 Allowed Glycine 0 CA--C 1.525 0.666 0 O-C-N 121.903 -0.498 . . . . 0.0 112.347 -175.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -138.08 127.0 23.98 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.563 0.745 . . . . 0.0 109.035 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.409 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.0 OUTLIER -114.07 165.57 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -175.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -122.35 -57.21 1.77 Allowed 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -154.52 162.55 41.09 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -142.8 152.54 17.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 124.474 1.11 . . . . 0.0 109.793 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -157.47 140.73 15.42 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -90.17 167.56 12.62 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 ptp -142.91 133.58 25.2 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 121.359 0.599 . . . . 0.0 111.7 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -5.66 54.62 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.648 1.179 . . . . 0.0 112.338 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 83.1 p -77.74 -1.23 30.24 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -140.24 156.37 69.98 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 124.452 1.101 . . . . 0.0 109.093 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -67.15 -12.57 36.49 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.181 2.587 . . . . 0.0 111.739 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.9 97.36 0.11 Allowed Glycine 0 C--N 1.337 0.621 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -157.33 159.82 37.88 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.963 0.505 . . . . 0.0 110.372 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -154.54 155.67 35.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.971 0.415 . . . . 0.0 111.048 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 43.7 ttm -108.98 148.76 30.24 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.479 1.112 . . . . 0.0 109.008 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.0 t -138.7 153.26 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 123.308 0.643 . . . . 0.0 111.431 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -140.8 132.52 27.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.332 0.515 . . . . 0.0 110.797 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 9.7 ptp -162.56 176.14 10.71 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.353 1.061 . . . . 0.0 110.535 -172.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.46 120.81 12.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 174.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -72.36 -33.47 67.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.42 -86.55 0.02 OUTLIER Glycine 0 CA--C 1.517 0.172 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . 0.264 72.9 m-85 -74.78 -25.57 59.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -86.78 -37.19 18.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.905 -175.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 99.3 t -82.36 -32.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.339 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -69.22 -41.02 77.58 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 176.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -68.2 -38.61 82.15 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.52 0.6 . . . . 0.0 111.844 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -64.45 -35.29 80.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.277 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 51.5 mt -77.65 -15.89 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.184 0.594 . . . . 0.0 111.177 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 28.4 m -93.67 -19.47 21.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -133.67 -20.46 2.03 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 116.558 2.059 . . . . 0.0 116.558 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.36 -12.88 2.39 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 120.795 1.634 . . . . 0.0 114.648 -172.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.604 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.47 100.96 2.32 Favored 'General case' 0 C--O 1.201 -1.471 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -168.309 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.9 m-80 78.63 22.05 0.72 Allowed 'General case' 0 N--CA 1.484 1.256 0 O-C-N 117.614 -3.179 . . . . 0.0 114.051 -161.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -74.16 162.8 28.59 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.428 -0.795 . . . . 0.0 109.706 167.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -80.22 142.45 34.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 172.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.6 ttt -158.64 134.28 8.81 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.352 45.6 m-85 58.39 11.04 1.5 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 117.884 2.55 . . . . 0.0 117.884 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 97.44 3.71 58.5 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -128.96 -165.01 1.45 Allowed 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.184 0.994 . . . . 0.0 108.933 176.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -126.1 149.88 48.6 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 122.683 0.393 . . . . 0.0 111.31 -177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.2 ptm -124.62 75.57 1.42 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.231 1.012 . . . . 0.0 109.637 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.8 m120 -51.98 127.06 20.2 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 115.618 -2.134 . . . . 0.0 112.821 -174.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.604 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.439 2.1 t -126.29 152.17 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 113.21 -3.396 . . . . 0.0 115.952 169.161 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.46 167.27 17.73 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.028 1.331 . . . . 0.0 109.069 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.94 147.48 11.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 40.4 t -87.49 159.78 18.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.901 0.481 . . . . 0.0 111.865 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -100.5 -8.04 23.55 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.377 0.271 . . . . 0.0 110.6 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -76.79 150.54 81.67 Favored Pre-proline 0 N--CA 1.455 -0.202 0 C-N-CA 123.477 0.711 . . . . 0.0 111.104 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.99 -36.11 1.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.558 2.839 . . . . 0.0 112.178 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.37 157.68 9.24 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.198 0.599 . . . . 0.0 110.726 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.02 142.96 13.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 78.7 mtp -115.27 126.78 27.43 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 122.072 0.149 . . . . 0.0 111.346 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -76.88 168.28 23.76 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.79 2.994 . . . . 0.0 109.875 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.47 -135.3 4.77 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -72.33 157.35 37.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.17 0.588 . . . . 0.0 109.663 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 470' ' ' SER . 96.6 p -148.79 177.88 9.14 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.593 0.357 . . . . 0.0 110.72 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -122.17 4.47 9.79 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 81.98 -177.54 53.8 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 54.8 mt -144.65 168.14 20.89 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 124.057 0.943 . . . . 0.0 109.911 -178.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 465' ' ' GLU . 2.3 pm0 -66.16 -31.1 71.74 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.203 0.601 . . . . 0.0 110.447 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -120.51 12.11 11.5 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -155.95 172.11 33.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 112.044 -0.423 . . . . 0.0 112.044 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.9 m -100.42 -18.39 16.74 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 10.6 p -127.13 154.31 44.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.306 0.643 . . . . 0.0 111.457 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . 0.448 ' H ' ' HB2' ' A' ' 461' ' ' SER . 90.0 p -83.64 -3.55 57.83 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 122.777 0.431 . . . . 0.0 111.424 178.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.25 2.3 t80 -121.11 150.2 41.6 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -175.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -152.76 151.47 30.53 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.734 0.302 . . . . 0.0 111.131 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -119.36 138.04 53.33 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.07 5.01 4.14 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 115.969 1.841 . . . . 0.0 115.969 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 46.7 t -66.63 -28.48 68.51 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.746 0.418 . . . . 0.0 111.449 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -95.98 -6.66 38.41 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.892 0.477 . . . . 0.0 111.32 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.2 t -80.45 146.99 31.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.602 0.361 . . . . 0.0 111.201 -178.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -91.28 4.43 52.35 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.48 0.312 . . . . 0.0 111.106 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -63.93 -22.91 67.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.792 0.269 . . . . 0.0 111.017 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -60.81 134.16 56.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.501 0.72 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.7 tpt85 -80.96 -33.62 33.76 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -176.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.302 56.4 m-85 -97.99 11.95 35.84 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 117.685 2.476 . . . . 0.0 117.685 -178.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 79.9 p -73.64 -10.35 59.61 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -172.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -136.47 147.81 61.42 Favored Pre-proline 0 N--CA 1.461 0.117 0 N-CA-C 115.405 1.631 . . . . 0.0 115.405 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 39.7 Cg_exo -64.77 -31.91 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.035 2.49 . . . . 0.0 112.392 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -79.15 -23.58 43.87 Favored 'General case' 0 CA--C 1.528 0.104 0 O-C-N 122.352 -0.218 . . . . 0.0 111.03 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -83.53 -41.34 18.06 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -61.33 -20.3 62.79 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.673 0.389 . . . . 0.0 111.874 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -77.75 -17.86 57.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -123.96 9.0 8.71 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -64.06 152.36 40.54 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.442 0.564 . . . . 0.0 111.998 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -143.85 125.97 15.49 Favored 'General case' 0 C--O 1.23 0.076 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 31.1 mm -143.38 -20.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.441 0.696 . . . . 0.0 110.838 -175.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 12.0 pm0 -65.4 160.67 21.44 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.513 0.725 . . . . 0.0 111.608 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 51.68 50.04 7.89 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 124.436 1.094 . . . . 0.0 113.893 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.67 146.6 84.54 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 122.634 2.223 . . . . 0.0 109.291 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 17.0 t -159.73 -157.91 0.61 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -175.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -83.74 0.6 46.52 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.319 0.648 . . . . 0.0 110.88 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 4.5 t -88.8 139.4 17.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 C-N-CA 123.337 0.655 . . . . 0.0 112.309 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.44 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 67.7 mt -122.19 156.63 33.31 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.458 0.703 . . . . 0.0 109.556 174.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -122.98 141.5 51.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -134.08 159.1 41.86 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.624 0.726 . . . . 0.0 110.706 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -151.51 163.37 39.16 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 103.093 -2.928 . . . . 0.0 103.093 -178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.48 57.33 4.42 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.551 0.341 . . . . 0.0 111.271 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -127.92 150.32 73.19 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 122.589 0.356 . . . . 0.0 111.1 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 505' ' ' ALA . 51.9 Cg_exo -56.37 153.36 34.66 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.7 2.933 . . . . 0.0 112.993 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 60.6 mt -68.54 -16.72 63.97 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.433 0.693 . . . . 0.0 112.506 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -122.81 23.84 9.28 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.838 0.855 . . . . 0.0 111.329 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.3 p -65.85 -12.01 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -175.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.709 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.7 OUTLIER -54.35 -176.86 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -166.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.709 ' H ' HG22 ' A' ' 510' ' ' THR . 22.6 pt-20 -23.39 -41.49 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.0 -48.55 78.19 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 117.107 -1.425 . . . . 0.0 114.082 172.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -87.78 -27.59 22.22 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 122.481 2.4 . . . . 0.0 106.919 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -63.28 -37.74 88.43 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.308 -0.957 . . . . 0.0 113.521 175.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -73.47 -43.34 60.41 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.35 -21.17 56.47 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 119.99 -0.684 . . . . 0.0 111.823 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.7 mt -74.93 -37.6 41.81 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 174.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 92.5 m -66.22 -37.07 84.67 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.052 -0.405 . . . . 0.0 110.618 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -70.61 -26.86 63.69 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -74.98 -26.31 59.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.494 0.318 . . . . 0.0 110.831 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 82.2 mt -98.47 -5.26 32.72 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.05 0.54 . . . . 0.0 111.509 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.83 -1.37 54.25 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.406 0.527 . . . . 0.0 112.861 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.9 m -77.87 159.48 4.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 117.734 0.767 . . . . 0.0 112.527 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -69.38 146.14 52.34 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 123.014 0.526 . . . . 0.0 111.221 -178.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -74.73 154.43 87.25 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.727 0.811 . . . . 0.0 111.44 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.76 157.19 61.24 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.382 2.722 . . . . 0.0 110.33 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -90.16 -17.15 28.13 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 25.1 t -158.88 155.21 27.33 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.653 0.381 . . . . 0.0 110.624 177.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.7 m -142.84 153.83 17.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 C-N-CA 123.637 0.775 . . . . 0.0 113.039 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -150.19 142.29 24.03 Favored 'General case' 0 N--CA 1.458 -0.055 0 C-N-CA 123.479 0.712 . . . . 0.0 109.71 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.39 150.79 22.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -155.81 178.83 9.82 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 94.5 p -141.66 169.78 16.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.476 0.71 . . . . 0.0 110.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 116.91 -16.91 13.29 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 123.937 0.78 . . . . 0.0 111.959 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -84.71 -24.61 28.83 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 117.522 0.661 . . . . 0.0 112.285 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.6 t -163.13 155.41 18.29 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.937 0.495 . . . . 0.0 110.153 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -96.79 -7.64 33.18 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.598 0.359 . . . . 0.0 110.722 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.13 -31.67 44.21 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 95.8 p -165.47 170.44 14.43 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.051 0.453 . . . . 0.0 111.724 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 47.5 t -86.26 163.82 17.52 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.6 0.76 . . . . 0.0 110.16 175.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 68.4 m -141.99 161.38 38.12 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.978 0.911 . . . . 0.0 108.68 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.44 43.56 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 119.888 -1.149 . . . . 0.0 113.309 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -118.77 158.35 25.75 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.782 0.833 . . . . 0.0 110.229 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 84.3 mt -141.1 157.92 44.64 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 124.594 1.157 . . . . 0.0 108.645 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -147.62 150.27 34.1 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.359 0.527 . . . . 0.0 111.567 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . 0.44 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 15.7 m-90 -126.48 164.23 21.62 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.514 1.126 . . . . 0.0 112.202 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.01 -11.05 60.6 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 44.0 t -156.01 162.04 40.38 Favored 'General case' 0 C--N 1.339 0.138 0 O-C-N 121.536 -0.728 . . . . 0.0 111.57 -178.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -65.55 -31.82 73.07 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 122.887 0.475 . . . . 0.0 110.333 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 79.1 p -76.42 -28.46 56.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.215 0.206 . . . . 0.0 110.728 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -73.6 -34.44 65.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.62 -30.62 61.72 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 175.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 49.7 tp -74.92 -38.82 61.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 122.331 0.252 . . . . 0.0 111.334 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -74.1 -40.08 62.95 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.844 -0.535 . . . . 0.0 110.044 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.8 -24.67 62.61 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -68.23 -34.87 77.03 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 171.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -68.97 -32.43 73.34 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.491 -0.616 . . . . 0.0 112.302 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.287 8.2 m-85 -95.59 -9.7 31.53 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.92 -11.19 11.54 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-N 119.082 0.856 . . . . 0.0 113.254 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -74.38 138.68 43.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 119.153 0.888 . . . . 0.0 109.331 178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 60.36 22.51 12.03 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.581 0.752 . . . . 0.0 112.484 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 29.1 t80 -81.54 145.77 30.5 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -73.8 144.58 45.51 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.78 -0.575 . . . . 0.0 111.869 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 65.5 mtm -83.54 152.54 24.84 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -90.36 124.94 35.34 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 172.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -155.75 77.55 4.63 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 123.404 0.682 . . . . 0.0 109.331 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.08 -16.74 53.35 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.22 2.613 . . . . 0.0 112.203 -173.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -88.16 -12.79 42.92 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.557 0.343 . . . . 0.0 111.594 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -93.5 161.12 24.9 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.0 -28.51 11.01 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.796 2.997 . . . . 0.0 111.341 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -158.34 151.98 19.33 Favored Pre-proline 0 N--CA 1.455 -0.2 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.87 162.08 43.02 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 123.466 2.777 . . . . 0.0 111.031 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -129.93 142.34 50.66 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.47 131.18 44.34 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -174.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.75 147.99 24.94 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.277 1.031 . . . . 0.0 109.347 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -140.8 154.11 46.1 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.793 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -158.59 161.37 37.24 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 27.0 p -158.36 174.82 14.55 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.495 0.718 . . . . 0.0 110.254 -176.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -59.73 124.26 19.56 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.423 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 30.2 t -85.67 150.35 24.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -171.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -110.38 9.25 23.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.66 163.37 16.51 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.609 0.764 . . . . 0.0 111.827 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.6 mm-40 -89.58 -3.08 58.46 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -169.98 178.02 4.11 Favored 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 123.415 0.686 . . . . 0.0 110.142 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -136.72 18.83 3.06 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.74 0.416 . . . . 0.0 111.568 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.501 -1.238 . . . . 0.0 110.526 179.946 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.437 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 O4'-C1'-N19 112.125 3.925 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.481 ' C2 ' ' HG3' ' A' ' 382' ' ' MET . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 O4'-C1'-N19 111.452 3.252 . 0.432 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.881 1 C3'-C2'-C1' 105.141 4.045 . 0.225 0b . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.716 1 C5'-C4'-C3' 109.11 -4.26 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 1 O4'-C1'-N19 113.844 5.644 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.526 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.785 0 C5'-C4'-C3' 109.919 -3.721 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.72 0 O4'-C1'-N19 112.12 3.92 . 0.051 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.925 0 C3'-C2'-C1' 104.531 3.368 . 0.055 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.423 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.758 0 O4'-C1'-N19 111.205 3.005 . 0.233 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.535 1 C5'-C4'-C3' 108.588 -4.608 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.284 7.8 p90 . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 178.11 -172.67 45.22 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.33 161.13 12.02 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.206 3.271 . . . . 0.0 112.184 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -155.38 160.33 40.61 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 110.893 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.98 161.41 31.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 122.828 0.451 . . . . 0.0 111.134 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -70.6 -5.08 26.61 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.0 t -160.55 145.68 10.97 Favored Pre-proline 0 N--CA 1.456 -0.127 0 O-C-N 122.183 -0.323 . . . . 0.0 111.446 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.78 -18.69 62.03 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.672 2.915 . . . . 0.0 111.626 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 5.3 t -94.57 153.68 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 C-N-CA 123.607 0.763 . . . . 0.0 112.194 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -141.09 153.52 45.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.271 1.028 . . . . 0.0 108.789 -178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 74.1 mmm -130.39 133.73 46.6 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 122.91 0.484 . . . . 0.0 111.695 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -120.75 151.78 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.422 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.2 m-85 -144.22 177.99 8.22 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 105.38 -2.082 . . . . 0.0 105.38 -177.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 82.3 12.04 81.25 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 112.034 -0.427 . . . . 0.0 112.034 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 48.8 mt -78.24 26.26 0.21 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.514 0.657 . . . . 0.0 112.203 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -64.37 -37.89 89.1 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -176.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.451 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.6 pm0 -67.07 150.42 49.22 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.182 0.515 . . . . 0.0 111.055 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -70.04 -8.71 51.52 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.666 0.786 . . . . 0.0 112.974 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -76.85 -13.88 59.95 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.73 0.412 . . . . 0.0 111.676 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 56.4 mmm -85.07 152.15 23.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.963 0.411 . . . . 0.0 111.099 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.73 155.37 23.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 175.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 411' ' ' PHE . 24.2 p -57.42 -32.0 66.44 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -175.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.06 -47.97 63.96 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 175.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 58.9 mtt85 -70.55 -39.11 74.17 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 116.821 -0.172 . . . . 0.0 110.972 -171.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.74 -46.35 74.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -77.68 -28.65 51.17 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.712 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -77.31 -29.11 53.51 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.392 0.997 . . . . 0.0 110.097 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . 0.576 HG22 HD12 ' A' ' 556' ' ' LEU . 2.7 t -59.93 -56.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.555 2.3 p90 -76.66 -3.21 36.65 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 173.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.503 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.4 t -73.01 -36.87 67.08 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.866 -0.521 . . . . 0.0 110.559 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.15 -11.67 22.11 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.779 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -89.22 -3.79 58.44 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.95 -169.82 41.05 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 118.795 0.725 . . . . 0.0 112.91 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -78.46 114.28 17.22 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 401' ' ' CYS . 2.5 m -114.09 165.49 9.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -127.87 -59.49 1.19 Allowed 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 43.4 pttt -154.42 167.81 28.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -172.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.1 150.42 15.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 124.827 1.251 . . . . 0.0 109.84 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -151.54 128.78 11.21 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 123.353 0.661 . . . . 0.0 110.805 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 393' ' ' CYS . 3.3 m-85 -82.84 156.95 23.35 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 117.396 2.369 . . . . 0.0 117.396 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.17 127.77 37.77 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.712 0.405 . . . . 0.0 110.846 175.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.636 ' HE2' " H5'" ' B' ' 4' ' ' ' C' . 0.0 OUTLIER -79.21 -29.14 42.66 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.849 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 52.2 p -102.02 -19.51 15.17 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -80.5 154.27 73.9 Favored Pre-proline 0 CA--C 1.528 0.129 0 CA-C-N 118.456 0.571 . . . . 0.0 110.047 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.84 -15.87 48.39 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 123.085 2.523 . . . . 0.0 111.136 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 166.66 98.19 0.12 Allowed Glycine 0 C--N 1.336 0.538 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 176.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.17 37.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.334 0.654 . . . . 0.0 110.209 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.75 148.85 19.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 62.8 mtp -85.03 150.77 24.64 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.348 1.059 . . . . 0.0 109.037 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.89 146.39 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 C-N-CA 123.48 0.712 . . . . 0.0 110.414 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.44 ' C ' ' HG3' ' A' ' 423' ' ' MET . 71.4 tt0 -129.42 129.81 45.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.374 0.534 . . . . 0.0 109.888 176.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . 0.546 ' HE2' ' HB1' ' A' ' 428' ' ' ALA . 49.9 mtp -150.77 167.68 26.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.335 1.054 . . . . 0.0 109.389 -169.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.76 122.38 17.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 170.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -72.34 -33.21 67.12 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -167.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.45 -89.57 0.01 OUTLIER Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.56 -25.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.546 ' HB1' ' HE2' ' A' ' 423' ' ' MET . . . -89.52 -35.15 16.1 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.908 -1.117 . . . . 0.0 111.99 -174.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 81.6 t -85.94 -26.12 6.42 Favored 'Isoleucine or valine' 0 C--N 1.345 0.401 0 C-N-CA 118.217 -1.393 . . . . 0.0 109.025 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -68.42 -50.06 55.51 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 172.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -66.91 -33.18 75.02 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 120.266 -0.574 . . . . 0.0 112.262 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -67.23 -36.72 82.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.841 0.746 . . . . 0.0 110.2 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 58.1 mt -79.21 -8.1 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.55 0.74 . . . . 0.0 111.184 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 19.7 m -100.08 -21.26 15.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -124.53 -27.77 3.68 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 -169.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 96.7 mt -134.52 -10.63 2.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.483 1.492 . . . . 0.0 114.711 -173.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.647 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -71.86 100.77 2.48 Favored 'General case' 0 C--O 1.204 -1.335 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -169.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.4 m-80 76.73 22.16 1.17 Allowed 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 123.381 2.81 . . . . 0.0 112.811 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.52 161.3 18.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 168.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.271 37.6 m-85 -74.47 138.4 43.2 Favored 'General case' 0 C--O 1.23 0.061 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.0 ttt -157.11 142.53 17.37 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.386 0.674 . . . . 0.0 109.603 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 59.34 17.55 5.95 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.42 85.31 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -173.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -133.32 -159.35 0.96 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.773 1.629 . . . . 0.0 108.598 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -128.62 151.02 49.96 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.551 0.341 . . . . 0.0 110.779 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -129.25 82.58 2.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.64 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -58.69 127.4 31.99 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 115.98 -1.962 . . . . 0.0 113.343 -172.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.647 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.409 2.1 t -129.94 150.93 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 113.593 -3.243 . . . . 0.0 115.953 168.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.3 t -161.49 167.7 25.02 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.585 1.154 . . . . 0.0 109.27 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -72.31 150.86 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 41.6 t -90.71 166.56 13.07 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.334 0.653 . . . . 0.0 111.492 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -106.13 -6.42 18.61 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.621 0.368 . . . . 0.0 110.455 175.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -77.74 152.03 80.13 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 123.98 0.912 . . . . 0.0 111.613 -178.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.52 -38.89 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 123.14 2.56 . . . . 0.0 112.045 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.55 159.38 10.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.608 0.763 . . . . 0.0 110.479 -178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 64.9 mt -80.51 128.87 38.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 24.8 mmm -94.78 140.61 22.62 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.361 0.265 . . . . 0.0 111.292 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -73.38 158.18 48.59 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 123.318 2.679 . . . . 0.0 109.065 172.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 160.33 -133.95 3.45 Favored Glycine 0 CA--C 1.524 0.647 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.694 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -72.31 167.8 19.69 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.441 0.696 . . . . 0.0 111.419 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 96.7 p -154.83 167.78 29.09 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.738 0.815 . . . . 0.0 109.785 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.78 -1.61 0.98 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.62 -171.14 54.41 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.5 mt -142.26 159.96 41.19 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.138 0.975 . . . . 0.0 109.229 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.55 -19.34 62.9 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -120.44 25.5 9.76 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -160.66 -159.15 9.71 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.7 t -133.0 -15.95 2.56 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 80.1 m -127.04 143.69 51.22 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.595 0.358 . . . . 0.0 111.441 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 71.9 p -93.84 3.47 55.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.348 0.659 . . . . 0.0 110.894 175.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -142.74 149.57 38.92 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.115 1.366 . . . . 0.0 114.254 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -154.61 152.88 30.53 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 117.994 0.361 . . . . 0.0 111.454 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -124.24 128.88 49.83 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.203 1.401 . . . . 0.0 112.45 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.282 3.3 m-85 -91.22 -6.64 53.07 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -177.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.7 t -75.09 -33.52 61.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -81.22 -17.07 50.85 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.575 0.35 . . . . 0.0 110.468 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 54.7 m -91.31 -3.81 56.47 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -176.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 60.91 -1.93 0.22 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.755 1.222 . . . . 0.0 113.204 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -64.73 -22.36 66.96 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.097 0.559 . . . . 0.0 112.064 -176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -59.42 115.6 3.38 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -81.02 -24.14 38.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.331 -0.395 . . . . 0.0 112.015 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.301 62.5 m-85 -97.94 17.44 18.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -64.1 -20.05 65.69 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.04 154.1 70.03 Favored Pre-proline 0 C--O 1.232 0.156 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 177.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -64.1 -23.49 67.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.087 2.525 . . . . 0.0 111.679 177.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -75.76 -29.46 58.82 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.331 -0.231 . . . . 0.0 110.675 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -82.0 -38.95 24.3 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.56 -19.67 65.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.667 0.387 . . . . 0.0 111.81 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.82 -16.73 54.91 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -124.0 0.37 8.52 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -65.33 157.25 29.66 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.289 178.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.71 118.28 10.96 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.93 41.85 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.437 0.695 . . . . 0.0 111.042 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -64.68 167.92 6.73 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.904 -0.498 . . . . 0.0 110.092 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -57.6 151.12 42.23 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 122.693 0.397 . . . . 0.0 110.777 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.12 162.27 36.42 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 123.479 2.786 . . . . 0.0 110.838 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 33.2 t -158.05 -176.86 6.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -83.68 -3.72 57.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 177.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.4 t -88.13 146.42 6.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 123.621 0.768 . . . . 0.0 112.572 175.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 8.8 tp -137.38 152.23 49.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.027 0.531 . . . . 0.0 109.833 -178.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -123.9 147.75 47.41 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.838 0.855 . . . . 0.0 109.131 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -142.29 161.53 37.79 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.689 0.757 . . . . 0.0 109.983 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -153.7 166.12 33.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 58.25 57.44 3.95 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 122.646 0.378 . . . . 0.0 111.434 -174.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -124.86 154.9 70.86 Favored Pre-proline 0 CA--C 1.533 0.299 0 C-N-CA 123.629 0.772 . . . . 0.0 109.935 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.41 156.74 64.91 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.202 1.935 . . . . 0.0 110.305 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.42 -16.53 63.95 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -173.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -115.36 25.14 11.06 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.5 0.72 . . . . 0.0 111.385 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.9 p -64.85 -14.24 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.699 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.96 -177.25 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -164.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.699 ' H ' HG22 ' A' ' 510' ' ' THR . 23.3 pt-20 -24.53 -39.4 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.1 mt-10 -59.27 -45.88 90.03 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 116.956 -1.497 . . . . 0.0 114.77 172.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -88.22 -27.18 21.95 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 122.852 2.569 . . . . 0.0 106.865 -174.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -65.77 -36.08 82.52 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.426 -0.909 . . . . 0.0 113.308 175.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -74.08 -44.26 54.68 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -76.59 -25.0 53.47 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.755 -0.778 . . . . 0.0 111.739 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.2 mt -72.22 -40.56 65.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 O-C-N 121.75 -0.594 . . . . 0.0 110.027 176.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 74.3 m -65.31 -30.24 71.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.23 0.468 . . . . 0.0 111.294 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -66.91 -39.44 87.4 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.915 0.388 . . . . 0.0 112.026 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -73.42 -6.75 48.29 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.04 -3.73 12.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.865 0.466 . . . . 0.0 111.778 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.88 -16.71 3.15 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.995 0.807 . . . . 0.0 113.931 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.5 m -77.39 156.8 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 118.461 1.13 . . . . 0.0 108.771 177.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -70.83 150.33 45.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.087 0.47 . . . . 0.0 111.496 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.3 ptt85 -76.19 157.41 83.1 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.311 0.644 . . . . 0.0 110.065 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.41 151.09 83.93 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 122.959 2.44 . . . . 0.0 110.549 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 3.0 t -83.53 -22.98 32.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -148.67 150.61 33.51 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.282 0.633 . . . . 0.0 110.665 178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 1.8 m -144.52 156.1 14.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.1 0 C-N-CA 123.655 0.782 . . . . 0.0 112.676 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -154.71 144.67 21.74 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.529 0.732 . . . . 0.0 109.505 175.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.96 152.48 28.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -155.51 -177.75 6.78 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.994 1.849 . . . . 0.0 115.994 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.1 p -143.49 -170.34 3.27 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.211 1.004 . . . . 0.0 109.846 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.56 -9.22 62.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.758 0.694 . . . . 0.0 112.254 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -94.43 -26.91 16.3 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 117.54 0.67 . . . . 0.0 111.648 178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.4 t -164.59 156.94 16.44 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.235 0.614 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.99 -8.03 31.54 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.842 0.457 . . . . 0.0 110.787 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.26 -33.64 37.7 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 28.0 t -164.94 157.43 16.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.63 0.252 . . . . 0.0 111.651 -173.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 95.3 p -82.9 176.24 9.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.454 0.702 . . . . 0.0 111.051 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.0 t -149.05 162.71 39.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.095 0.958 . . . . 0.0 108.445 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.31 -174.45 47.0 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.124 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.52 160.18 23.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.598 0.759 . . . . 0.0 110.394 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 73.5 mt -139.77 161.33 37.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.113 1.365 . . . . 0.0 108.347 178.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -151.38 148.39 28.07 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.248 -0.282 . . . . 0.0 111.573 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 22.2 m-90 -129.07 173.67 10.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.877 1.271 . . . . 0.0 111.915 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -7.99 54.74 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 46.8 t -162.03 165.06 27.83 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.193 -0.317 . . . . 0.0 111.295 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.92 -37.62 86.54 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 122.968 0.507 . . . . 0.0 110.269 176.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 87.2 p -72.26 -27.26 62.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -71.8 -39.75 69.67 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 175.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.6 -27.14 60.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 62.4 tp -77.89 -40.35 40.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -178.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -70.96 -36.76 72.69 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.65 -23.78 59.91 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . 0.576 HD12 HG22 ' A' ' 399' ' ' VAL . 0.9 OUTLIER -67.85 -44.57 76.83 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 173.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -61.55 -37.16 93.72 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-O 119.668 -0.518 . . . . 0.0 112.113 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.292 25.2 m-85 -84.95 -13.33 51.05 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 94.9 mt -110.81 -10.15 14.45 Favored 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -72.62 144.19 47.91 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.274 0.943 . . . . 0.0 108.829 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 58.77 18.96 6.44 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.952 0.901 . . . . 0.0 112.852 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.45 131.78 51.29 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -77.38 124.83 28.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 121.866 -0.522 . . . . 0.0 110.747 -177.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.0 mtm -83.54 152.57 24.82 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.287 0.235 . . . . 0.0 111.406 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -74.19 145.83 43.88 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -156.42 79.0 4.01 Favored Pre-proline 0 N--CA 1.455 -0.21 0 O-C-N 122.435 -0.166 . . . . 0.0 110.684 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -72.15 -9.93 25.17 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 123.083 2.522 . . . . 0.0 111.027 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.52 5.7 50.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.565 0.746 . . . . 0.0 112.455 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -153.13 166.79 31.65 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-N 118.314 0.506 . . . . 0.0 112.196 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.88 -17.44 22.6 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 124.268 3.312 . . . . 0.0 112.393 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -150.14 150.83 30.56 Favored Pre-proline 0 C--O 1.231 0.124 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.99 167.41 27.12 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 123.889 3.059 . . . . 0.0 111.266 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -129.87 142.44 50.67 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 103.177 -2.897 . . . . 0.0 103.177 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.271 0.7 OUTLIER -81.63 141.14 33.95 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -178.018 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.8 tt -86.46 152.52 22.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.954 1.302 . . . . 0.0 109.455 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 17.0 pttp -140.44 153.53 46.32 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.159 0.436 . . . . 0.0 110.697 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.46 161.71 38.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.191 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.5 p -161.6 171.52 17.89 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.971 0.909 . . . . 0.0 110.908 -176.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -55.67 125.33 20.67 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.412 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 31.2 t -81.65 150.16 28.19 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -171.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.9 t -113.72 9.3 17.71 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.91 163.15 20.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.831 0.852 . . . . 0.0 111.542 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -89.41 -7.27 55.51 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.347 0.659 . . . . 0.0 111.776 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -172.49 172.21 4.41 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 123.668 0.787 . . . . 0.0 110.273 176.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -140.92 20.31 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.243 0.617 . . . . 0.0 111.793 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.2 t . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.691 -1.147 . . . . 0.0 110.499 179.878 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.422 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.728 0 O4'-C1'-N19 111.565 3.365 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.418 0 C5'-C4'-C3' 110.391 -3.406 . 0.386 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.511 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.895 0 O4'-C1'-N19 112.07 3.87 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . 0.636 " H5'" ' HE2' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.419 -2.818 1 C5'-C4'-C3' 108.261 -4.826 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.727 1 O4'-C1'-N19 113.43 5.23 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.563 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.865 0 C5'-C4'-C3' 109.741 -3.839 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 C5'-C4'-C3' 110.978 -3.015 . 0.01 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 C3'-C2'-C1' 104.509 3.343 . 0.063 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.412 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.419 -2.796 0 O4'-C1'-N19 111.092 2.892 . 0.241 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.67 1 C5'-C4'-C3' 108.223 -4.851 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.291 7.3 p90 . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 75.08 -177.88 47.61 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.871 -0.491 . . . . 0.0 111.871 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -59.69 158.46 28.21 Favored 'Trans proline' 0 N--CA 1.454 -0.849 0 C-N-CA 124.515 3.477 . . . . 0.0 112.435 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -157.72 153.52 26.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.801 0.44 . . . . 0.0 110.701 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -77.8 157.78 29.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.468 0.307 . . . . 0.0 110.3 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 8.6 p30 -84.02 6.57 21.56 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 115.886 1.809 . . . . 0.0 115.886 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 379' ' ' PRO . 29.8 t -153.72 143.98 15.62 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 119.387 -0.339 . . . . 0.0 111.105 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 378' ' ' SER . 34.5 Cg_exo -62.22 -3.03 3.56 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 124.387 3.391 . . . . 0.0 113.455 176.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.06 151.01 28.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.3 tt -122.37 153.54 38.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.526 1.531 . . . . 0.0 108.291 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.7 tpt -135.13 128.41 32.08 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 117.773 0.26 . . . . 0.0 110.64 -176.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -122.4 153.23 26.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -175.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.517 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 3.2 m-85 -142.98 175.91 9.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.365 -2.458 . . . . 0.0 104.365 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.64 15.91 67.17 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 37.7 mt -86.46 19.6 2.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.389 0.675 . . . . 0.0 111.557 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.321 8.4 p30 -73.48 32.29 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 117.285 2.328 . . . . 0.0 117.285 -173.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -140.55 154.54 46.57 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 110.29 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 86.8 p -66.05 -11.45 48.44 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -172.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -78.63 -9.49 59.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.203 0.456 . . . . 0.0 111.635 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 60.1 mmm -97.32 149.75 21.74 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 117.936 0.334 . . . . 0.0 110.224 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -161.55 154.86 21.2 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 22.3 p -59.18 -35.8 74.19 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.16 -38.71 78.89 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -74.4 -51.33 15.3 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.98 -33.9 63.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.211 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.427 ' HA ' ' CE1' ' A' ' 400' ' ' PHE . 5.5 t80 -75.66 -30.64 59.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.584 -174.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -74.83 -32.46 61.95 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.443 1.019 . . . . 0.0 110.068 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . 0.431 HG22 ' CD2' ' A' ' 556' ' ' LEU . 30.0 t -57.52 -57.7 9.13 Favored 'Isoleucine or valine' 0 C--N 1.341 0.229 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 397' ' ' PHE 0.49 2.6 p90 -76.54 -5.08 46.08 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 117.646 2.462 . . . . 0.0 117.646 174.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.456 ' HA ' HG11 ' A' ' 406' ' ' VAL . 40.5 t -74.32 -34.54 63.48 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 118.198 0.453 . . . . 0.0 111.133 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' A' ' 403' ' ' TYR . 3.0 pp -61.41 -16.46 46.9 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.959 177.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 402' ' ' LEU 0.252 55.2 m-85 -85.08 -5.28 59.35 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 118.298 2.703 . . . . 0.0 118.298 -179.556 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.91 -167.07 39.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.475 -0.869 . . . . 0.0 113.303 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -84.95 120.06 26.07 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.683 0.793 . . . . 0.0 109.361 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.456 HG11 ' HA ' ' A' ' 401' ' ' CYS . 1.4 m -113.94 165.49 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.053 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -174.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -133.36 -57.36 0.9 Allowed 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -149.79 164.28 35.72 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.44 147.01 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 124.625 1.17 . . . . 0.0 109.073 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.4 130.36 11.0 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.335 0.254 . . . . 0.0 111.64 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.3 m-85 -85.0 156.08 21.29 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.9 mmt -95.75 118.02 31.63 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.534 0.733 . . . . 0.0 112.244 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -79.11 -14.35 59.18 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.914 0.485 . . . . 0.0 111.124 172.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.7 p -90.26 1.47 56.47 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.625 0.77 . . . . 0.0 111.875 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . 0.435 ' HE2' " O3'" ' B' ' 1' ' ' ' A' . 46.8 mmtm -136.06 155.21 77.76 Favored Pre-proline 0 CA--C 1.53 0.174 0 C-N-CA 123.664 0.786 . . . . 0.0 110.46 -176.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.76 -15.67 33.37 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 123.249 2.633 . . . . 0.0 111.624 178.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.78 95.21 0.1 OUTLIER Glycine 0 C--N 1.338 0.654 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.14 159.42 36.16 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.879 0.872 . . . . 0.0 109.281 177.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -162.56 156.64 21.1 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 71.8 mtm -102.58 154.73 18.84 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.427 0.691 . . . . 0.0 109.997 172.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 14.2 t -142.05 124.93 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 123.314 0.646 . . . . 0.0 110.893 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -103.62 127.84 51.0 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 31.1 mtm -154.63 172.4 17.92 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.796 0.838 . . . . 0.0 109.85 -174.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.79 122.07 16.04 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -72.35 -33.47 67.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -53.79 -87.97 0.01 OUTLIER Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -73.01 -26.81 61.46 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 117.185 2.291 . . . . 0.0 117.185 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -85.8 -37.19 19.52 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 119.052 -1.059 . . . . 0.0 111.798 -174.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 60.0 t -85.87 -26.22 6.43 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.622 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -66.42 -51.91 52.0 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 122.164 -0.335 . . . . 0.0 111.391 175.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -69.93 -31.15 68.77 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.38 72.66 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.915 0.78 . . . . 0.0 110.089 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -78.11 -15.48 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 123.222 0.609 . . . . 0.0 110.752 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 14.4 m -93.01 -18.88 22.15 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.458 ' C ' HD22 ' A' ' 436' ' ' LEU . 95.7 m-70 -129.77 -21.37 3.08 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -170.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.458 HD22 ' C ' ' A' ' 435' ' ' HIS . 3.5 mm? -134.71 -12.34 2.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.956 1.707 . . . . 0.0 114.311 -174.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.73 100.92 2.45 Favored 'General case' 0 C--O 1.205 -1.237 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -168.172 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.58 ' CG ' ' HA ' ' A' ' 447' ' ' ASN . 15.0 m-80 77.04 21.51 1.11 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 123.159 2.709 . . . . 0.0 113.771 -161.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -78.84 161.32 26.85 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.94 -1.1 . . . . 0.0 111.155 168.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . 0.418 ' CZ ' ' HE3' ' A' ' 445' ' ' LYS . 55.7 m-85 -71.3 142.42 50.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.2 ttt -162.5 134.52 5.42 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.392 50.8 m-85 55.98 27.32 11.06 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 83.72 8.78 84.02 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -132.5 178.33 6.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.315 1.046 . . . . 0.0 109.266 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . 0.418 ' HE3' ' CZ ' ' A' ' 440' ' ' PHE . 40.1 ttmt -125.19 133.75 52.64 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 111.033 178.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 63.0 mtm -80.63 -158.18 0.18 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.404 1.082 . . . . 0.0 109.046 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.58 ' HA ' ' CG ' ' A' ' 438' ' ' ASN . 37.1 t-20 -162.59 123.26 2.46 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 115.631 -2.128 . . . . 0.0 108.599 168.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.45 2.2 t -125.86 151.42 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 112.337 -3.745 . . . . 0.0 116.556 170.371 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 26.1 t -161.38 174.94 12.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.714 1.606 . . . . 0.0 107.938 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.2 p -73.95 149.36 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 28.3 t -84.21 158.45 21.29 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.882 0.473 . . . . 0.0 110.973 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.499 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 65.0 pttt -104.45 -1.81 26.21 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.459 -0.151 . . . . 0.0 110.692 176.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -86.79 146.47 41.18 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 123.176 0.59 . . . . 0.0 110.066 176.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.57 -31.14 4.49 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.319 2.68 . . . . 0.0 112.493 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.47 161.28 13.81 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.022 0.529 . . . . 0.0 110.382 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 79.0 mt -87.76 136.54 22.9 Favored 'Isoleucine or valine' 0 C--O 1.23 0.062 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 59.8 mmm -101.39 130.16 25.38 Favored Pre-proline 0 N--CA 1.455 -0.209 0 C-N-CA 122.458 0.303 . . . . 0.0 110.913 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.54 171.42 18.07 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.608 2.872 . . . . 0.0 110.402 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 131.41 -125.41 4.4 Favored Glycine 0 C--N 1.336 0.551 0 N-CA-C 111.424 -0.67 . . . . 0.0 111.424 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -72.47 164.91 25.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.361 0.6 . . . . 0.0 112.21 -176.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 97.0 p -158.4 -179.16 7.84 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.154 0.981 . . . . 0.0 109.529 -177.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -140.88 161.96 36.58 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -80.65 131.69 10.67 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.4 mt -80.0 166.81 21.2 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.07 -22.57 64.0 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.248 -0.282 . . . . 0.0 111.178 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -120.52 25.83 9.54 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.154 0.582 . . . . 0.0 110.242 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -162.36 -163.07 14.33 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 121.859 -0.526 . . . . 0.0 112.419 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 48.4 t -133.09 -16.69 2.46 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.061 0.544 . . . . 0.0 111.551 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.5 t -127.09 145.98 50.54 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.957 0.503 . . . . 0.0 110.059 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 89.8 p -97.47 9.51 42.19 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.403 0.681 . . . . 0.0 111.628 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -136.15 147.24 47.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -157.84 154.15 27.55 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.606 0.362 . . . . 0.0 110.188 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 2.4 t0 -131.85 130.3 41.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 178.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -93.63 -8.89 39.8 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 117.252 2.315 . . . . 0.0 117.252 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 48.3 t -87.19 -32.27 19.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -79.25 3.8 16.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.568 0.747 . . . . 0.0 111.711 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 77.4 p -134.21 9.01 3.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.292 0.637 . . . . 0.0 111.767 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 62.77 -0.86 0.52 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.845 1.258 . . . . 0.0 113.986 176.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -59.21 -26.6 64.98 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.698 -0.626 . . . . 0.0 111.864 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -56.32 124.21 17.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.167 0.987 . . . . 0.0 109.994 -179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -81.02 -32.14 34.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -172.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.306 63.2 m-85 -97.92 17.1 18.99 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.9 p -69.12 -14.31 62.92 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -173.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.6 OUTLIER -137.58 151.75 71.53 Favored Pre-proline 0 C--O 1.232 0.139 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 33.5 Cg_exo -65.0 -23.83 60.88 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 123.02 2.48 . . . . 0.0 111.426 176.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -75.71 -29.7 59.05 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 122.359 0.263 . . . . 0.0 110.452 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -82.4 -41.98 19.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 174.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.83 64.81 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -80.79 -19.04 45.66 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -4.5 7.96 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -63.67 157.14 24.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.276 0.489 . . . . 0.0 110.414 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -150.44 144.83 25.66 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.4 mm -137.65 148.05 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 123.331 0.652 . . . . 0.0 110.225 -171.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -150.51 169.04 22.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.108 0.963 . . . . 0.0 110.186 178.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -62.88 155.92 69.02 Favored Pre-proline 0 N--CA 1.455 -0.213 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -62.21 145.49 96.19 Favored 'Trans proline' 0 N--CA 1.45 -1.058 0 C-N-CA 122.521 2.147 . . . . 0.0 109.561 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.2 t -153.98 173.99 15.25 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.978 0.511 . . . . 0.0 109.653 -174.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.71 -3.06 57.47 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 122.268 -0.27 . . . . 0.0 110.935 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -98.38 135.86 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.437 HD12 ' CZ3' ' A' ' 546' ' ' TRP . 64.8 mt -125.41 152.14 45.25 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.372 0.669 . . . . 0.0 109.717 174.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -110.51 143.59 40.64 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 173.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -131.28 157.77 42.42 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.224 0.535 . . . . 0.0 111.647 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -152.19 167.68 27.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 103.847 -2.649 . . . . 0.0 103.847 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 54.39 31.87 15.39 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -93.57 156.21 39.93 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 117.685 0.22 . . . . 0.0 110.864 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.73 151.14 57.65 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 123.326 2.684 . . . . 0.0 111.754 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.46 -16.58 63.95 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.315 0.646 . . . . 0.0 112.412 -177.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -122.67 26.42 8.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.579 0.752 . . . . 0.0 111.005 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.57 -14.22 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.705 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.3 OUTLIER -54.74 -177.39 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -165.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.705 ' H ' HG22 ' A' ' 510' ' ' THR . 84.6 tt0 -10.33 -53.74 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.176 1.79 . . . . 0.0 114.919 -174.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.5 mt-10 -61.4 -41.18 96.72 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -89.35 -27.33 20.56 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 123.262 2.755 . . . . 0.0 106.398 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -61.71 -39.96 93.37 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.875 -1.13 . . . . 0.0 113.09 174.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -70.47 -45.95 64.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -77.88 -24.95 48.33 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 119.918 -0.713 . . . . 0.0 111.468 -177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 53.2 mt -70.53 -39.14 75.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 118.867 0.758 . . . . 0.0 109.417 176.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 85.6 m -65.66 -32.8 74.56 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.98 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -70.16 -27.18 64.33 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -80.02 -9.19 59.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.273 0.229 . . . . 0.0 111.577 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.26 -5.95 14.61 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.096 0.558 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.55 -10.06 13.48 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 123.715 0.674 . . . . 0.0 113.025 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.9 m -79.82 159.03 4.46 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.102 0 CA-C-N 118.131 0.966 . . . . 0.0 112.45 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -67.59 148.44 51.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 121.179 0.514 . . . . 0.0 111.376 -176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -81.6 158.07 68.97 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.602 0.761 . . . . 0.0 110.884 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.24 170.88 12.41 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 123.864 3.043 . . . . 0.0 110.43 172.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.0 t -119.21 -17.97 8.77 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 64.5 m -147.49 146.84 29.65 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 123.187 0.595 . . . . 0.0 109.884 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.24 156.94 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -175.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -150.34 141.05 22.66 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 3.3 t -138.53 142.17 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -154.06 -172.79 4.33 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 22.8 t -136.84 -174.29 3.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.625 0.77 . . . . 0.0 110.11 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 92.88 -15.53 62.53 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.04 0.828 . . . . 0.0 111.758 -178.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 50.4 mmtm -88.46 -28.32 20.93 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.453 0.627 . . . . 0.0 110.742 175.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.9 t -166.31 158.93 14.4 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.599 0.76 . . . . 0.0 109.963 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -117.05 -4.19 11.5 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.441 0.696 . . . . 0.0 109.855 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -24.26 21.55 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.654 0.782 . . . . 0.0 110.637 -179.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 13.0 m -158.71 167.17 30.22 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 123.763 0.825 . . . . 0.0 111.073 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 46.9 t -79.61 164.13 24.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.64 0.776 . . . . 0.0 111.569 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 39.6 t -151.95 150.42 30.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.479 1.111 . . . . 0.0 109.376 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 170.56 -173.6 44.43 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.815 -178.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -112.05 157.66 20.5 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 123.318 0.647 . . . . 0.0 110.17 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 28.2 tp -146.32 151.74 38.01 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -147.04 149.25 32.73 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . 0.437 ' CZ3' HD12 ' A' ' 500' ' ' LEU . 17.7 m-90 -121.38 172.0 8.36 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.491 1.516 . . . . 0.0 112.536 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -74.99 -11.07 60.03 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.612 0.365 . . . . 0.0 111.137 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -156.72 158.96 37.86 Favored 'General case' 0 C--O 1.232 0.135 0 O-C-N 121.629 -0.669 . . . . 0.0 111.375 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.5 -26.25 62.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.537 0.335 . . . . 0.0 110.851 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.1 p -78.64 -25.53 45.01 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.75 -35.36 70.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 175.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.4 -28.55 59.48 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.755 -0.202 . . . . 0.0 110.665 176.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 39.6 tp -72.79 -44.02 62.06 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 117.875 0.307 . . . . 0.0 111.131 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -72.72 -39.48 66.89 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.904 -0.498 . . . . 0.0 109.947 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.47 -26.92 65.73 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . 0.431 ' CD2' HG22 ' A' ' 399' ' ' VAL . 5.7 tt -68.23 -32.39 72.56 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 172.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.39 -41.48 99.76 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.265 10.5 m-85 -89.05 -18.79 26.59 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 118.743 2.868 . . . . 0.0 118.743 178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.81 -16.68 15.33 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.754 0.706 . . . . 0.0 112.323 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -73.82 143.81 45.78 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 119.317 0.962 . . . . 0.0 108.846 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.85 18.45 2.99 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.516 1.126 . . . . 0.0 112.966 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.264 43.8 t80 -72.88 138.55 46.33 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -73.86 134.03 43.24 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.131 -0.356 . . . . 0.0 111.813 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.6 mtm -84.58 152.6 23.75 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 122.679 0.392 . . . . 0.0 111.663 176.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 168.77 17.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 170.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -150.04 149.28 27.02 Favored Pre-proline 0 CA--C 1.532 0.262 0 O-C-N 122.28 -0.263 . . . . 0.0 111.107 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.4 -29.59 9.18 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.304 2.669 . . . . 0.0 112.421 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -160.53 8.07 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -67.28 148.28 49.88 Favored Glycine 0 CA--C 1.532 1.123 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 -177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.94 -24.29 17.72 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.417 2.745 . . . . 0.0 111.368 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -153.55 149.82 22.06 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -74.59 163.51 35.79 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.663 2.909 . . . . 0.0 111.238 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -129.91 142.33 50.67 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 174.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.266 0.7 OUTLIER -81.94 138.7 34.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -177.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.8 tt -79.67 152.29 30.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.64 153.5 46.05 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.902 0.319 . . . . 0.0 110.665 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.33 166.33 33.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.784 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 43.1 t -155.92 160.03 39.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.91 0.884 . . . . 0.0 109.761 -173.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -57.37 119.2 6.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.477 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 38.9 t -76.14 148.15 38.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 4.8 t -114.14 11.77 17.66 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 169.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.6 163.04 22.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.887 0.875 . . . . 0.0 111.942 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -93.53 -3.14 53.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.742 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -153.33 170.56 20.34 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.539 0.736 . . . . 0.0 110.752 -177.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.34 23.49 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.051 0.94 . . . . 0.0 109.873 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.369 -1.3 . . . . 0.0 110.61 -176.116 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.517 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.697 1 O4'-C1'-N19 112.335 4.135 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.499 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.75 0 C5'-C4'-C3' 110.428 -3.381 . 0.34 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.554 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.955 0 C3'-C2'-C1' 104.915 3.794 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.91 1 C5'-C4'-C3' 108.6 -4.6 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . 0.456 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.897 1 O4'-C1'-N19 112.755 4.555 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.503 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.821 0 C5'-C4'-C3' 109.711 -3.86 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.874 0 O4'-C1'-N19 111.269 3.069 . 0.098 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.927 0 C3'-C2'-C1' 105.022 3.914 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.477 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.421 -2.675 0 O4'-C1'-N19 111.946 3.746 . 0.189 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.817 2 C5'-C4'-C3' 108.364 -4.758 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.255 8.0 p90 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -72.71 171.31 50.21 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.34 162.48 41.7 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.124 3.216 . . . . 0.0 111.08 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -156.01 156.51 34.56 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.796 0.439 . . . . 0.0 110.564 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.05 160.68 30.94 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.879 0.472 . . . . 0.0 111.034 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -73.78 -7.34 51.76 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 28.7 t -159.92 148.37 13.55 Favored Pre-proline 0 C--O 1.232 0.144 0 C-N-CA 122.924 0.489 . . . . 0.0 110.547 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.55 -16.01 46.19 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.26 2.64 . . . . 0.0 110.557 174.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -85.37 150.55 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.44 156.3 46.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.65 1.18 . . . . 0.0 108.563 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 45.6 tpp -137.48 135.72 37.08 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.208 -0.308 . . . . 0.0 111.082 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.17 152.0 34.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -176.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.487 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 13.4 m-85 -138.78 177.9 7.55 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 9.89 82.2 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.896 -0.391 . . . . 0.0 112.255 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 44.4 mt -78.27 28.03 0.19 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.473 0.709 . . . . 0.0 111.851 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -64.89 -27.55 68.93 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -175.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.49 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.5 pm0 -79.16 150.91 31.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.006 0.431 . . . . 0.0 111.208 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.7 m -70.72 -5.83 32.77 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.02 -15.32 61.52 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 118.093 0.406 . . . . 0.0 111.921 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 71.3 mmm -95.13 147.08 23.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.196 0.453 . . . . 0.0 111.382 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -158.73 163.52 36.72 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.357 1.063 . . . . 0.0 108.508 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 86.8 m -54.28 -44.62 72.04 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.061 0.391 . . . . 0.0 110.857 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -68.01 -37.28 81.24 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -74.08 -48.39 30.07 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 p -75.09 -39.62 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 406' ' ' VAL . 6.9 t80 -75.91 -31.91 59.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -71.05 -38.45 72.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.159 0.436 . . . . 0.0 110.198 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -61.82 -48.32 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 120.102 -0.639 . . . . 0.0 112.608 -176.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.523 2.5 p90 -76.6 -12.07 59.96 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 168.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 42.3 t -66.86 -24.79 66.18 Favored 'General case' 0 C--N 1.338 0.071 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . 0.436 HD21 ' HB3' ' A' ' 578' ' ' CYS . 0.5 OUTLIER -49.52 -37.16 25.65 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.242 0.617 . . . . 0.0 110.926 173.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -79.51 -14.86 58.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -176.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 173.16 -174.6 45.99 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 118.939 0.791 . . . . 0.0 112.946 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -73.54 124.88 26.73 Favored 'General case' 0 C--O 1.231 0.109 0 O-C-N 122.644 -0.327 . . . . 0.0 111.754 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.443 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 1.4 m -114.09 165.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.096 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 178.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -126.42 -59.51 1.3 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -146.58 166.18 27.27 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 118.852 0.751 . . . . 0.0 112.98 -173.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.28 148.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 124.472 1.109 . . . . 0.0 109.332 175.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -157.3 126.19 5.81 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.116 0.566 . . . . 0.0 111.042 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.92 153.87 38.41 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 36.4 mmt -86.62 117.03 25.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 123.308 0.643 . . . . 0.0 110.317 175.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.411 ' HD3' " H5'" ' B' ' 4' ' ' ' C' . 11.5 ptmm? -79.21 -15.77 57.55 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.425 -0.172 . . . . 0.0 111.4 171.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 32.5 t -90.15 -5.88 55.98 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -124.34 154.81 69.1 Favored Pre-proline 0 CA--C 1.531 0.215 0 C-N-CA 123.351 0.66 . . . . 0.0 109.836 -176.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.26 -17.06 40.03 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 123.412 2.741 . . . . 0.0 111.86 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 177.08 94.75 0.09 OUTLIER Glycine 0 C--N 1.336 0.536 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -159.41 163.01 35.84 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.537 0.735 . . . . 0.0 109.462 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.39 143.04 13.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 84.7 mtp -82.59 151.68 26.27 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.8 t -146.53 153.79 12.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -177.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . 0.413 ' C ' ' HG3' ' A' ' 423' ' ' MET . 79.8 tt0 -135.22 133.42 39.0 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.102 -0.374 . . . . 0.0 110.002 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . 0.413 ' HG3' ' C ' ' A' ' 422' ' ' GLU . 60.4 mtp -150.59 169.35 21.77 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.197 0.999 . . . . 0.0 109.461 -171.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.465 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.9 123.04 18.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 171.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.2 p30 -72.29 -33.55 67.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 -166.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -57.37 -89.62 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -73.33 -25.47 60.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.72 -32.68 16.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 118.735 -1.186 . . . . 0.0 112.208 -174.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.68 -24.31 6.09 Favored 'Isoleucine or valine' 0 C--N 1.343 0.304 0 C-N-CA 118.04 -1.464 . . . . 0.0 109.031 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -69.34 -47.78 63.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.785 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -63.7 -40.25 96.31 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.06 -36.72 85.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.464 0.574 . . . . 0.0 110.589 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 69.8 mt -81.73 -10.16 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 123.066 0.547 . . . . 0.0 111.706 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 52.8 m -102.26 -16.56 16.27 Favored 'General case' 0 N--CA 1.461 0.082 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -135.42 -19.74 1.65 Allowed 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -170.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 8.9 tp -134.57 -15.34 2.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -170.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 17.8 p-10 -71.38 101.0 2.28 Favored 'General case' 0 C--O 1.204 -1.31 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -169.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 10.7 m-80 78.2 21.98 0.82 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 123.988 3.085 . . . . 0.0 113.889 -161.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -76.05 159.76 30.48 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.331 -0.855 . . . . 0.0 110.713 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -78.12 138.78 38.9 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 174.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.8 ttt -159.23 135.81 9.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.793 0.437 . . . . 0.0 109.919 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.329 51.9 m-85 58.07 21.56 8.01 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.79 7.24 88.37 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -174.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -124.18 -167.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.365 1.466 . . . . 0.0 108.459 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -138.4 151.19 47.25 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.546 0.338 . . . . 0.0 110.534 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -130.42 87.66 2.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.2 m120 -56.26 129.47 40.42 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 115.541 -2.171 . . . . 0.0 111.594 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.447 1.9 t -125.88 149.45 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 113.531 -3.268 . . . . 0.0 116.353 168.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 42.0 t -159.54 165.97 31.81 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.778 1.231 . . . . 0.0 108.166 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.0 p -71.38 148.63 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 22.2 t -85.34 161.98 19.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.017 0.527 . . . . 0.0 110.851 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.472 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 65.1 pttt -106.74 -0.23 23.7 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 117.515 0.143 . . . . 0.0 110.914 177.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -82.01 151.55 67.15 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.53 0.732 . . . . 0.0 110.317 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -77.43 -35.88 1.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.257 2.638 . . . . 0.0 112.208 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.76 158.84 9.34 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.352 0.661 . . . . 0.0 110.583 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.4 mt -79.96 146.71 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 81.9 mtp -119.25 130.14 25.01 Favored Pre-proline 0 N--CA 1.454 -0.253 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.87 163.81 34.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.632 2.888 . . . . 0.0 110.122 176.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 153.03 -125.04 1.71 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -72.43 166.62 22.21 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 122.948 0.499 . . . . 0.0 111.239 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 34.3 t -157.81 165.73 34.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.615 0.766 . . . . 0.0 109.773 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -125.62 -1.61 7.39 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 77.79 -178.8 51.83 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.005 0.336 . . . . 0.0 112.488 -178.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 90.5 mt -143.77 160.53 40.56 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.964 0.906 . . . . 0.0 109.769 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.51 -12.0 61.16 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.752 0.421 . . . . 0.0 111.647 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -120.48 20.74 11.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.175 0.59 . . . . 0.0 110.29 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -169.77 -153.37 8.52 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.2 m -132.92 -15.44 2.63 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.2 t -127.06 146.25 50.43 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.753 0.421 . . . . 0.0 110.117 176.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.7 p -93.82 10.5 32.88 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.415 0.686 . . . . 0.0 110.874 176.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -135.61 147.92 48.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -156.77 154.24 29.63 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-O 120.704 0.288 . . . . 0.0 110.375 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.26 0.4 OUTLIER -132.63 140.19 48.09 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.888 0.875 . . . . 0.0 113.148 179.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . 0.291 15.8 m-85 -111.03 8.61 21.96 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 117.638 2.458 . . . . 0.0 117.638 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.2 t -71.67 -28.68 63.9 Favored 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -92.5 -18.66 22.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.919 0.888 . . . . 0.0 111.289 178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 75.0 m -76.59 -17.78 59.01 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.93 2.24 0.97 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.66 1.184 . . . . 0.0 114.103 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -62.74 -15.4 53.05 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.462 -0.774 . . . . 0.0 112.862 -178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.21 124.62 17.58 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.81 0.444 . . . . 0.0 110.976 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -72.81 -33.52 66.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.62 -173.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.328 57.9 m-85 -98.02 17.27 18.75 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 47.2 t -61.76 -22.11 65.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -172.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.413 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -136.48 152.05 74.1 Favored Pre-proline 0 C--N 1.339 0.134 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -178.073 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 31.3 Cg_exo -63.68 -31.73 69.25 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.249 2.632 . . . . 0.0 112.43 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -78.86 -21.74 47.08 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 117.689 0.222 . . . . 0.0 111.091 -178.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -80.66 -41.95 22.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.84 -20.02 64.66 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.633 0.373 . . . . 0.0 111.912 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.42 -20.41 47.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.04 2.59 8.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -61.99 155.76 22.94 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.315 0.507 . . . . 0.0 111.934 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 18.4 mtt180 -141.92 131.57 24.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -176.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.5 mm -139.65 145.11 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 C-N-CA 123.723 0.809 . . . . 0.0 109.001 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -158.29 159.22 35.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.152 0.581 . . . . 0.0 109.455 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -60.51 158.61 29.06 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -61.35 146.1 97.6 Favored 'Trans proline' 0 N--CA 1.451 -1.026 0 C-N-CA 122.292 1.995 . . . . 0.0 109.946 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -153.7 171.47 18.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -175.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -83.65 -7.88 59.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 1.9 t -85.46 141.92 13.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 174.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 11.7 tp -139.9 150.94 45.2 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.515 0.326 . . . . 0.0 110.209 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -125.01 150.06 47.1 Favored 'General case' 0 C--N 1.334 -0.106 0 C-N-CA 124.05 0.94 . . . . 0.0 108.848 -177.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -139.63 159.26 42.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.294 0.568 . . . . 0.0 111.952 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -150.42 166.34 30.39 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 17.3 m120 54.42 57.16 6.06 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.341 0.257 . . . . 0.0 111.215 -175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' A' ' 506' ' ' PRO . . . -129.34 150.61 76.02 Favored Pre-proline 0 CA--C 1.531 0.239 0 C-N-CA 122.455 0.302 . . . . 0.0 110.929 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.421 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 52.2 Cg_exo -55.96 156.51 19.5 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.703 2.936 . . . . 0.0 113.014 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.27 -16.68 64.05 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.461 0.704 . . . . 0.0 111.058 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -122.67 24.3 9.2 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.89 0.876 . . . . 0.0 110.831 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 6.0 p -63.3 -13.16 12.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -55.37 -177.6 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 117.977 -1.011 . . . . 0.0 113.556 -165.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.672 ' H ' HG22 ' A' ' 510' ' ' THR . 22.8 pt-20 -21.29 -41.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -170.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.3 mt-10 -56.1 -48.75 75.54 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 117.413 -1.28 . . . . 0.0 114.413 172.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -87.07 -26.07 23.87 Favored 'General case' 0 C--N 1.35 0.61 0 CA-C-N 122.474 2.397 . . . . 0.0 106.886 -173.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -66.98 -38.22 85.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -73.39 -40.27 64.46 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -76.07 -22.82 55.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.483 -177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 55.8 mt -77.08 -45.31 30.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 CA-C-N 118.417 0.553 . . . . 0.0 110.924 178.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 28.4 p -71.81 -27.58 63.02 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.599 -178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -71.7 -36.77 70.65 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.792 0.33 . . . . 0.0 111.499 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.61 -28.77 66.22 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.388 0.275 . . . . 0.0 111.307 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 91.4 mt -94.85 -5.63 44.59 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.658 0.383 . . . . 0.0 111.569 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.86 1.61 62.84 Favored Glycine 0 CA--C 1.531 1.052 0 CA-C-O 119.584 -0.564 . . . . 0.0 113.119 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.3 m -76.91 163.65 3.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 118.18 0.99 . . . . 0.0 112.941 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.43 144.97 53.22 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -83.43 144.18 45.86 Favored Pre-proline 0 N--CA 1.455 -0.215 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.154 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -70.17 151.61 66.82 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.303 2.668 . . . . 0.0 110.839 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -95.51 -17.61 21.31 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 176.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 27.8 t -152.42 159.79 43.35 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-O 120.597 0.237 . . . . 0.0 111.031 175.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 7.5 p -155.27 150.1 11.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 C-N-CA 123.184 0.593 . . . . 0.0 110.267 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -150.53 144.06 25.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.465 1.106 . . . . 0.0 108.8 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.21 151.94 31.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -156.61 -173.27 4.4 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -178.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 90.8 p -140.42 -177.47 5.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.011 0.924 . . . . 0.0 110.376 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 98.26 -8.97 62.91 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 123.839 0.733 . . . . 0.0 112.223 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.32 -28.26 21.15 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.95 0.875 . . . . 0.0 111.437 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 43.5 t -166.4 159.71 14.92 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.26 0.624 . . . . 0.0 110.057 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -97.08 -7.83 31.79 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.631 0.372 . . . . 0.0 110.296 175.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -79.77 -30.52 40.73 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.8 p -164.91 168.7 17.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.196 0.522 . . . . 0.0 112.057 -173.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 40.6 t -82.82 166.93 18.57 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.756 0.823 . . . . 0.0 110.325 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 62.7 m -142.65 159.23 42.64 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.349 1.06 . . . . 0.0 108.405 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.47 -174.16 46.66 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 119.834 -1.175 . . . . 0.0 113.415 -179.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.24 160.27 22.5 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.691 0.796 . . . . 0.0 110.699 -177.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 87.6 mt -142.03 162.47 35.41 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.572 1.549 . . . . 0.0 108.198 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -152.32 148.69 27.82 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.26 -0.275 . . . . 0.0 110.907 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 10.5 m-90 -126.41 175.27 7.99 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 125.228 1.411 . . . . 0.0 112.624 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -75.59 -9.78 58.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 42.0 t -161.38 158.09 26.31 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 122.852 0.461 . . . . 0.0 110.635 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.0 -21.01 63.26 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.361 0.264 . . . . 0.0 111.13 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 83.3 p -80.69 -24.83 38.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 117.929 0.331 . . . . 0.0 110.65 177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 58.9 m-20 -76.26 -34.16 59.16 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -75.16 -26.29 59.01 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 175.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 43.1 tp -77.41 -35.75 53.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.726 0.41 . . . . 0.0 110.882 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.97 -37.58 75.82 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.9 m -72.77 -30.21 63.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -63.48 -33.83 76.44 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.0 -56.58 17.67 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.285 14.3 m-85 -82.38 -16.89 47.48 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -175.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.74 -13.95 14.91 Favored 'General case' 0 C--N 1.338 0.08 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -73.68 142.3 46.41 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.894 1.225 . . . . 0.0 108.995 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 60.67 10.55 2.67 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.49 1.116 . . . . 0.0 112.967 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.252 33.6 t80 -73.48 141.47 46.82 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -73.02 142.48 47.69 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . 0.421 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 78.4 mtm -83.58 152.33 24.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.316 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -76.47 -20.26 57.18 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.335 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 38.11 77.67 0.4 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.529 1.132 . . . . 0.0 112.91 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.58 -1.53 9.3 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.789 2.993 . . . . 0.0 112.684 -174.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 36.4 p30 -143.52 1.41 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -90.57 154.78 23.57 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.71 -23.16 19.72 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 123.387 2.725 . . . . 0.0 110.957 177.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -154.06 154.0 29.26 Favored Pre-proline 0 CA--C 1.529 0.164 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.76 154.51 67.64 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 123.126 2.551 . . . . 0.0 111.704 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -130.01 142.45 50.63 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 102.887 -3.005 . . . . 0.0 102.887 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 145.87 50.85 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 116.064 1.876 . . . . 0.0 116.064 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 5.4 tt -100.96 153.95 19.09 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.891 1.276 . . . . 0.0 108.378 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.8 155.42 44.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 120.982 0.42 . . . . 0.0 111.042 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.44 162.91 38.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.57 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . 0.436 ' HB3' HD21 ' A' ' 402' ' ' LEU . 17.0 p -159.24 164.86 34.62 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.473 0.709 . . . . 0.0 111.442 -172.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -56.53 123.51 15.06 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 40.1 t -77.43 145.65 37.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.268 0.8 OUTLIER -110.86 9.09 22.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 169.802 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.47 164.23 19.25 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.957 0.903 . . . . 0.0 111.112 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -90.75 1.31 56.99 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.939 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -177.41 176.58 1.29 Allowed 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.531 1.132 . . . . 0.0 109.856 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -138.96 20.05 2.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.967 0.507 . . . . 0.0 111.226 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.248 -179.406 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.487 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.419 -2.808 0 O4'-C1'-N19 112.117 3.917 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.472 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C5'-C4'-C3' 110.661 -3.226 . 0.393 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.537 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.856 0 O4'-C1'-N19 111.626 3.426 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . 0.411 " H5'" ' HD3' ' A' ' 413' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.916 1 C5'-C4'-C3' 108.041 -4.973 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.763 1 O4'-C1'-N19 113.129 4.929 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.517 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.594 0 C5'-C4'-C3' 109.982 -3.679 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.833 0 O4'-C1'-N19 111.09 2.89 . 0.071 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.94 0 C3'-C2'-C1' 104.365 3.184 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.867 0 O4'-C1'-N19 111.09 2.89 . 0.217 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.634 1 C5'-C4'-C3' 108.113 -4.924 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.25 55.7 m-85 . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.61 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -68.32 168.92 18.1 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.111 3.208 . . . . 0.0 110.847 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -149.3 156.87 42.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.988 0.423 . . . . 0.0 110.74 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -73.58 162.39 29.27 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.901 0.48 . . . . 0.0 111.164 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -72.64 -8.0 53.13 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -178.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 30.5 t -159.64 148.53 14.02 Favored Pre-proline 0 N--CA 1.455 -0.221 0 C-N-CA 122.635 0.374 . . . . 0.0 110.948 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.57 -19.29 44.17 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.697 2.931 . . . . 0.0 111.56 172.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.79 148.56 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.0 tt -132.67 152.83 51.58 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.981 1.313 . . . . 0.0 108.372 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 16.6 tpt -135.96 132.44 36.39 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -175.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.38 153.6 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.503 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 2.5 m-85 -143.85 166.14 25.75 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 104.778 -2.304 . . . . 0.0 104.778 -178.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 91.62 11.3 60.82 Favored Glycine 0 CA--C 1.529 0.914 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 54.3 mt -81.19 35.11 0.38 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.934 0.894 . . . . 0.0 110.91 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . 0.292 8.5 p30 -81.65 25.21 0.54 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -171.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -134.45 157.79 45.56 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 123.042 0.537 . . . . 0.0 110.684 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 89.5 p -69.08 -11.53 60.87 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.65 0.78 . . . . 0.0 112.962 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -80.31 -9.25 59.73 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 122.5 0.32 . . . . 0.0 111.563 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 61.6 mmm -96.23 144.26 26.59 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 118.021 0.373 . . . . 0.0 110.273 -177.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -159.51 153.22 22.86 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 24.5 p -58.54 -30.23 66.94 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -72.05 -41.84 66.99 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 177.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 84.6 mtt-85 -75.99 -44.97 37.06 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 120.731 0.301 . . . . 0.0 111.245 -175.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.3 t -67.29 -41.73 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -174.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -73.63 -41.14 63.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 0.495 ' HA ' ' SG ' ' A' ' 401' ' ' CYS . 3.9 p30 -66.56 -31.13 71.64 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 119.696 -0.802 . . . . 0.0 109.269 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.84 -60.77 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 107.186 -1.412 . . . . 0.0 107.186 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.481 0.6 OUTLIER -76.61 -20.48 56.7 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 118.936 2.939 . . . . 0.0 118.936 177.765 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 398' ' ' ASN . 2.8 p -81.64 -19.26 42.13 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.07 0.85 . . . . 0.0 111.139 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 402' ' ' LEU . 3.5 pp -61.29 -15.2 32.88 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.978 0.808 . . . . 0.0 111.107 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -76.46 -8.12 56.51 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -171.14 -147.57 5.69 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 -175.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -88.22 159.88 17.95 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.712 0.405 . . . . 0.0 110.965 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.469 HG22 ' HB3' ' A' ' 480' ' ' ASN . 1.7 m -114.17 154.07 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -176.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -144.77 -74.66 0.24 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -149.05 167.58 25.48 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 -172.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 4.3 p -154.81 147.28 13.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 124.794 1.237 . . . . 0.0 108.551 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -157.04 133.37 9.81 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -81.39 168.32 18.49 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 115.942 1.83 . . . . 0.0 115.942 177.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 50.5 mtt -130.89 128.18 40.03 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-O 120.9 0.381 . . . . 0.0 111.6 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.4 ' HG3' ' H ' ' A' ' 413' ' ' LYS . 0.0 OUTLIER -79.2 -5.94 55.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.832 0.853 . . . . 0.0 112.341 175.145 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.5 p -83.32 -7.25 59.61 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.331 0.652 . . . . 0.0 112.451 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.08 157.55 77.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 C-N-CA 123.86 0.864 . . . . 0.0 109.422 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.93 -14.25 43.0 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.26 2.64 . . . . 0.0 111.235 177.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.74 98.67 0.11 Allowed Glycine 0 C--N 1.338 0.645 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 175.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.84 158.17 36.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.36 0.664 . . . . 0.0 109.492 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -157.39 150.85 23.9 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.275 0.559 . . . . 0.0 112.231 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 34.6 ttm -96.57 151.8 19.25 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.559 1.144 . . . . 0.0 108.313 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 37.9 t -144.85 154.28 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -142.42 135.8 28.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 71.7 mtm -160.45 177.58 10.42 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.355 1.462 . . . . 0.0 108.987 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.61 125.5 24.47 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 171.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -72.3 -33.57 67.5 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.34 -84.43 0.04 OUTLIER Glycine 0 C--N 1.333 0.413 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -73.52 -29.32 62.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.25 -35.14 18.67 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.431 -174.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.43 -24.96 6.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.311 0 C-N-CA 118.916 -1.114 . . . . 0.0 109.828 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -70.33 -50.37 39.85 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.46 174.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -64.32 -36.05 82.86 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.623 -0.673 . . . . 0.0 112.032 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.63 -34.57 78.53 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.005 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 54.2 mt -80.62 -8.04 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.528 0.731 . . . . 0.0 111.141 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 7.1 m -100.37 -18.87 16.56 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 176.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -131.89 -21.34 2.44 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -170.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 86.7 mt -134.43 -14.37 2.25 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 19.0 p-10 -71.65 100.86 2.39 Favored 'General case' 0 C--O 1.205 -1.285 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -170.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.525 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 22.7 m-80 77.07 21.94 1.06 Allowed 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 124.11 3.141 . . . . 0.0 112.526 -159.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -87.65 154.95 20.19 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 168.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -78.33 140.58 38.78 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.0 ttt -154.87 134.63 12.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.198 0.599 . . . . 0.0 110.272 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.388 48.4 m-85 59.43 19.09 7.44 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.93 10.73 62.46 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 120.017 -0.324 . . . . 0.0 112.446 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -146.14 150.18 35.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 117.411 0.606 . . . . 0.0 110.405 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -84.94 149.69 25.46 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.253 -0.279 . . . . 0.0 110.928 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -131.37 92.43 3.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.983 0.513 . . . . 0.0 109.636 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.525 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 21.5 t-20 -58.51 130.7 48.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 115.877 -2.011 . . . . 0.0 112.048 -171.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.451 2.2 t -124.88 149.7 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 113.46 -3.296 . . . . 0.0 116.416 168.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 34.4 t -161.39 172.91 15.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.162 1.385 . . . . 0.0 108.302 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.92 145.7 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 30.2 t -85.55 157.93 20.27 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 122.744 0.418 . . . . 0.0 110.877 177.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -96.57 -4.32 41.46 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.435 -0.166 . . . . 0.0 110.777 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -78.95 152.15 76.84 Favored Pre-proline 0 N--CA 1.454 -0.249 0 C-N-CA 123.736 0.814 . . . . 0.0 111.111 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.13 -34.81 1.04 Allowed 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.56 2.84 . . . . 0.0 112.068 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.28 159.76 10.97 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 122.961 0.504 . . . . 0.0 111.107 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.3 mt -78.27 136.7 23.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 61.4 mmm -103.59 125.12 35.7 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 122.311 0.244 . . . . 0.0 110.975 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -78.16 173.31 14.1 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.904 3.07 . . . . 0.0 110.187 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 128.52 -108.57 0.92 Allowed Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -72.42 153.17 41.56 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.349 0.659 . . . . 0.0 110.679 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.2 p -159.04 175.22 13.8 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.28 0.632 . . . . 0.0 110.095 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -143.33 163.82 31.97 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . -79.91 135.11 14.5 Favored Glycine 0 CA--C 1.525 0.659 0 O-C-N 122.099 -0.376 . . . . 0.0 112.66 -174.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.34 165.58 14.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.253 0.621 . . . . 0.0 109.516 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -72.7 -19.54 61.38 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.162 -0.336 . . . . 0.0 111.732 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -120.52 24.9 10.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.088 0.555 . . . . 0.0 109.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.2 -159.62 13.08 Favored Glycine 0 C--N 1.337 0.631 0 O-C-N 121.715 -0.616 . . . . 0.0 111.817 -177.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 47.5 t -133.09 -17.86 2.36 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 45.8 t -127.1 143.53 51.25 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 122.73 0.412 . . . . 0.0 110.04 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 87.6 p -86.74 1.59 51.62 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 123.168 0.587 . . . . 0.0 111.809 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . 0.258 19.6 t80 -128.57 145.72 51.05 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 115.634 1.716 . . . . 0.0 115.634 -178.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -153.61 149.5 27.66 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.857 0.463 . . . . 0.0 109.952 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.251 0.1 OUTLIER -130.2 140.87 50.69 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 179.006 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . 0.408 ' HB3' HG21 ' A' ' 406' ' ' VAL 0.267 65.7 m-85 -111.75 -2.43 15.3 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -178.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 44.7 t -73.59 -26.31 60.75 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.13 14.99 2.06 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.699 0.8 . . . . 0.0 111.028 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 48.3 t -137.24 169.23 18.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.604 0.762 . . . . 0.0 110.56 -177.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.04 6.49 31.2 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.111 0.565 . . . . 0.0 111.569 -176.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -62.06 -18.5 60.85 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . 0.469 ' HB3' HG22 ' A' ' 406' ' ' VAL . 0.4 OUTLIER -59.08 117.92 5.25 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.098 0.559 . . . . 0.0 111.657 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -81.17 -33.59 32.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.277 62.3 m-85 -97.94 3.5 49.6 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 117.488 2.403 . . . . 0.0 117.488 -176.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 57.8 m -87.76 7.0 32.32 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -172.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.448 ' HA ' ' HD3' ' A' ' 485' ' ' PRO . 0.7 OUTLIER -132.77 144.46 53.0 Favored Pre-proline 0 C--O 1.231 0.1 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 177.278 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 484' ' ' THR . 35.0 Cg_exo -64.66 -29.58 60.36 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.024 2.482 . . . . 0.0 112.372 -178.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -81.33 -26.4 35.66 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.667 -0.206 . . . . 0.0 111.18 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -82.25 -42.35 19.01 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.29 0.496 . . . . 0.0 110.906 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.35 -16.45 54.52 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.97 -21.52 33.98 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -124.04 4.13 8.64 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -64.02 155.44 31.14 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.779 0.718 . . . . 0.0 111.493 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -144.06 126.21 15.56 Favored 'General case' 0 N--CA 1.458 -0.062 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -174.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 26.8 mm -148.63 123.25 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 C-N-CA 124.351 1.06 . . . . 0.0 108.324 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -162.1 97.68 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.901 0.318 . . . . 0.0 110.781 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 496' ' ' PRO . 15.1 p80 54.32 155.13 0.05 OUTLIER Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 127.501 2.32 . . . . 0.0 114.596 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 495' ' ' HIS . 91.5 Cg_endo -75.7 76.2 3.75 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.536 2.824 . . . . 0.0 109.837 176.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.1 t -65.01 161.0 19.61 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.129 0.572 . . . . 0.0 110.856 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -83.84 -7.41 59.45 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 5.0 t -85.32 148.7 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.952 0.901 . . . . 0.0 110.8 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 10.2 tp -136.59 151.57 49.5 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -123.25 146.21 48.04 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -140.13 155.64 46.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.459 0.647 . . . . 0.0 109.34 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -148.44 163.77 36.15 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 104.423 -2.436 . . . . 0.0 104.423 -174.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 60.94 57.23 2.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.733 0.813 . . . . 0.0 112.044 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -137.39 137.09 21.42 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.945 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -49.83 159.91 1.42 Allowed 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.863 3.042 . . . . 0.0 113.038 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 507' ' ' LEU . 2.9 mp -68.52 -16.5 63.9 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -173.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.6 19.93 11.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 15.2 m -71.55 5.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.67 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.8 OUTLIER -54.88 -177.34 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 117.497 -1.24 . . . . 0.0 113.223 -167.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.67 ' H ' HG22 ' A' ' 510' ' ' THR . 23.2 pt-20 -23.64 -37.29 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -171.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 92.9 mt-10 -56.85 -49.74 74.56 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 117.416 -1.278 . . . . 0.0 114.009 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -85.1 -25.75 27.34 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 122.286 2.312 . . . . 0.0 106.69 -174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -65.87 -38.37 88.61 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -74.44 -42.12 59.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.47 -24.64 59.07 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.094 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 56.9 mt -74.48 -38.68 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.27 0.486 . . . . 0.0 109.983 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 93.5 m -67.41 -36.61 81.61 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 122.023 -0.423 . . . . 0.0 110.863 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -69.62 -29.18 66.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -76.58 -27.36 55.81 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 122.15 0.18 . . . . 0.0 111.186 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 80.1 mt -96.07 -6.06 39.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.893 0.477 . . . . 0.0 111.62 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 76.47 -8.57 25.81 Favored Glycine 0 CA--C 1.528 0.887 0 CA-C-O 119.472 -0.627 . . . . 0.0 113.195 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 m -76.92 155.37 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 118.384 1.092 . . . . 0.0 112.022 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -68.54 151.12 47.22 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.297 0.57 . . . . 0.0 112.024 -173.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -71.94 155.04 92.4 Favored Pre-proline 0 CA--C 1.528 0.122 0 C-N-CA 123.984 0.913 . . . . 0.0 111.286 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.24 155.1 65.12 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.387 2.725 . . . . 0.0 110.949 175.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -88.38 -20.57 25.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 14.1 t -153.91 164.03 39.08 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 110.994 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 3.1 p -160.34 146.81 5.93 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 C-N-CA 123.119 0.568 . . . . 0.0 109.469 -176.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -143.23 137.8 29.2 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 124.166 0.986 . . . . 0.0 108.929 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.2 146.99 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.343 0.657 . . . . 0.0 110.834 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -155.38 174.84 14.66 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 -173.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 80.8 p -62.93 134.78 56.73 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.503 0.668 . . . . 0.0 110.347 177.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -70.84 163.96 53.49 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.502 -175.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -81.05 12.13 3.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.411 1.084 . . . . 0.0 111.5 177.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 30.2 t -155.38 -172.73 4.27 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.335 1.054 . . . . 0.0 108.968 -177.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -96.85 -7.88 32.36 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -89.55 110.4 21.25 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.428 0.691 . . . . 0.0 110.593 172.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 68.2 m 53.6 -163.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.882 0.873 . . . . 0.0 112.954 174.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 20.7 m -140.8 178.49 7.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.523 1.129 . . . . 0.0 110.896 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 67.8 m -137.6 168.56 19.42 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . -174.88 179.32 46.26 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.669 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -121.75 158.4 28.87 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.729 0.812 . . . . 0.0 109.864 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.1 mt -141.26 166.7 24.05 Favored 'General case' 0 N--CA 1.457 -0.107 0 C-N-CA 124.728 1.211 . . . . 0.0 109.385 -178.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -153.85 150.74 28.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 122.193 -0.317 . . . . 0.0 110.708 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 20.8 m-90 -130.54 165.52 22.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.792 1.237 . . . . 0.0 111.638 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -68.17 -7.04 26.63 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.2 t -160.13 160.92 33.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.559 0.344 . . . . 0.0 110.794 -178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -67.46 -27.96 67.47 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 177.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.0 m -76.95 -26.58 54.18 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.462 0.305 . . . . 0.0 110.727 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.19 -36.89 66.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 177.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.95 -24.55 52.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 175.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 54.9 tp -78.79 -36.81 42.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.895 0.478 . . . . 0.0 111.481 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -75.22 -38.73 60.55 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.7 m -68.85 -24.41 64.35 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.33 -33.7 73.52 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.42 -27.03 73.26 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.34 9.1 m-85 -100.31 -6.11 26.39 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 118.961 2.949 . . . . 0.0 118.961 177.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 87.6 mt -123.9 -9.42 7.76 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -73.36 139.69 46.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.838 1.199 . . . . 0.0 109.356 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 56.19 17.44 2.76 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.311 1.045 . . . . 0.0 112.719 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -70.32 138.94 51.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -74.42 129.55 37.98 Favored 'General case' 0 N--CA 1.455 -0.185 0 O-C-N 122.195 -0.315 . . . . 0.0 111.083 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 77.9 mtm -83.53 152.45 24.89 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.569 0.223 . . . . 0.0 111.122 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -74.31 -16.74 60.92 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.933 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 40.91 80.47 0.28 Allowed Pre-proline 0 CA--C 1.533 0.311 0 C-N-CA 125.752 1.621 . . . . 0.0 112.476 177.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -73.56 9.09 1.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 124.018 3.145 . . . . 0.0 112.165 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -139.02 21.47 2.63 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -176.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -157.37 159.9 30.12 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 122.088 -0.382 . . . . 0.0 112.726 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.03 -16.45 20.14 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 124.715 3.61 . . . . 0.0 112.909 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . 0.262 4.7 p90 -144.31 148.97 43.03 Favored Pre-proline 0 CA--C 1.528 0.104 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.4 157.06 57.51 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.588 2.859 . . . . 0.0 112.264 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.87 142.46 50.66 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 102.807 -3.035 . . . . 0.0 102.807 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.253 0.7 OUTLIER -73.35 137.56 44.81 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -86.3 138.25 31.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.928 1.291 . . . . 0.0 108.145 175.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.99 146.57 50.62 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.597 0.635 . . . . 0.0 110.458 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.3 161.29 39.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.091 0.472 . . . . 0.0 111.281 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.53 172.14 14.85 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.039 0.935 . . . . 0.0 110.166 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -54.99 121.96 9.85 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.438 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 32.1 t -78.65 152.33 31.75 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.4 t -118.61 10.64 12.59 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 170.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.33 162.49 14.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.47 0.652 . . . . 0.0 111.867 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -82.99 8.88 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.894 0.878 . . . . 0.0 112.741 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -160.2 178.11 9.98 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.475 0.579 . . . . 0.0 111.31 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.51 12.43 1.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.085 0.954 . . . . 0.0 110.112 169.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.39 -1.29 . . . . 0.0 110.401 -176.391 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.503 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.422 -2.596 0 O4'-C1'-N19 112.16 3.96 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.782 0 C5'-C4'-C3' 110.446 -3.37 . 0.4 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.561 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.809 0 O4'-C1'-N19 111.797 3.597 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.661 1 C5'-C4'-C3' 108.942 -4.372 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.936 1 O4'-C1'-N19 112.844 4.644 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.55 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 C5'-C4'-C3' 109.652 -3.898 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.621 0 O4'-C1'-N19 111.496 3.296 . 0.021 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.074 0 C3'-C2'-C1' 104.722 3.58 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.438 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O4'-C1'-N19 111.007 2.807 . 0.23 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.635 1 O4'-C1'-N19 112.897 4.697 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.282 17.5 t80 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -179.35 173.22 45.22 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.07 176.3 7.95 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.408 3.405 . . . . 0.0 110.84 177.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -147.3 153.37 39.65 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 122.836 0.455 . . . . 0.0 110.719 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -76.28 159.47 30.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.767 0.427 . . . . 0.0 110.714 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -82.44 1.48 37.3 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.4 t -157.77 145.38 13.72 Favored Pre-proline 0 N--CA 1.456 -0.174 0 C-N-CA 122.83 0.452 . . . . 0.0 110.69 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.54 -15.05 41.04 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.661 2.907 . . . . 0.0 110.676 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.3 t -88.93 149.0 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.57 155.88 47.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.253 1.021 . . . . 0.0 108.429 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.1 tpt -139.37 133.76 31.55 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 122.01 -0.431 . . . . 0.0 110.808 -174.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.16 153.53 37.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.519 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 6.9 m-85 -139.48 166.45 24.53 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 90.68 9.48 64.37 Favored Glycine 0 CA--C 1.529 0.954 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.659 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.8 mt -78.1 25.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.77 0.785 . . . . 0.0 112.483 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -67.49 -15.57 63.74 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -72.21 155.36 40.31 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.644 -0.66 . . . . 0.0 111.958 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 69.8 p -68.72 -9.17 48.98 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 123.591 0.756 . . . . 0.0 111.328 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -95.63 5.08 52.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.723 0.809 . . . . 0.0 111.254 -173.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 59.1 mmm -106.33 138.14 43.04 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -177.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -160.18 157.98 29.3 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.443 0.697 . . . . 0.0 109.863 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 92.9 m -52.27 -41.76 63.13 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.58 0.352 . . . . 0.0 111.668 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -72.17 -36.51 69.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 76.8 mtt-85 -76.02 -47.25 25.58 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -174.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 18.6 t -69.75 -40.78 79.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -174.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.404 ' CZ ' ' CG2' ' A' ' 406' ' ' VAL . 3.6 t80 -78.27 -31.34 49.01 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.009 -170.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -74.66 -31.05 61.81 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 119.897 1.226 . . . . 0.0 109.84 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.78 -56.48 17.58 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.556 2.3 p90 -76.55 -3.79 39.36 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 174.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 35.7 t -75.05 -35.11 61.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 122.07 -0.394 . . . . 0.0 111.357 177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.4 -15.46 36.85 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -80.69 -7.18 59.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 116.91 2.189 . . . . 0.0 116.91 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . -179.54 -130.64 1.49 Allowed Glycine 0 CA--C 1.527 0.79 0 CA-C-N 118.289 0.495 . . . . 0.0 111.963 -175.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -136.49 124.15 22.38 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.404 ' CG2' ' CZ ' ' A' ' 397' ' ' PHE . 1.4 m -114.02 165.46 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -174.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -118.04 -61.49 1.67 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . 0.402 ' HE2' ' HB ' ' A' ' 456' ' ' ILE . 19.4 pttm -154.38 166.16 34.09 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 10.5 p -145.57 152.03 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 C-N-CA 124.604 1.162 . . . . 0.0 109.828 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -155.62 131.84 10.16 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.254 3.3 m-85 -82.73 164.03 20.92 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 116.871 2.175 . . . . 0.0 116.871 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 25.8 mmt -106.7 120.4 41.89 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.336 0.654 . . . . 0.0 112.44 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -79.1 -20.52 48.5 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.625 0.77 . . . . 0.0 111.31 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 42.3 t -81.45 -19.51 42.25 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.061 0.545 . . . . 0.0 112.355 -175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -115.64 157.87 43.28 Favored Pre-proline 0 N--CA 1.456 -0.156 0 C-N-CA 123.371 0.669 . . . . 0.0 109.759 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.25 -18.55 55.9 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.712 2.275 . . . . 0.0 110.791 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 176.64 103.82 0.17 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 176.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.36 162.37 33.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.802 0.841 . . . . 0.0 109.194 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.13 147.0 16.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 112.067 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 80.2 mtp -90.02 152.82 21.0 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.308 170.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.63 152.56 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 123.603 0.761 . . . . 0.0 110.228 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -136.31 130.35 32.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.595 0.634 . . . . 0.0 109.84 175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.0 mtp -151.0 171.22 17.63 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.449 0.7 . . . . 0.0 109.14 -169.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.52 123.27 19.2 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -72.61 -33.43 66.67 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -167.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.9 -88.66 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -72.27 -26.47 62.0 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -175.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -90.15 -34.23 15.94 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.265 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.18 -24.44 6.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 118.096 -1.442 . . . . 0.0 109.155 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -67.6 -50.41 58.38 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.527 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -65.18 -38.88 91.9 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.53 -37.51 85.17 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.785 0.72 . . . . 0.0 109.987 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 57.8 mt -77.45 -9.08 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.453 0.701 . . . . 0.0 111.713 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 76.7 m -102.85 -15.52 16.19 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -133.11 -24.81 1.84 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 -169.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 4.5 mp -133.98 -12.33 2.55 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.385 1.448 . . . . 0.0 113.329 -172.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.626 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.8 p-10 -70.97 101.15 2.12 Favored 'General case' 0 C--O 1.206 -1.208 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -169.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 13.1 m-80 77.1 22.07 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 124.518 3.326 . . . . 0.0 113.669 -161.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.12 162.94 20.1 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 167.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -81.21 138.61 35.8 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.3 ttt -153.74 137.85 16.45 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.46 0.704 . . . . 0.0 109.71 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.381 47.5 m-85 57.46 21.53 7.07 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 90.95 7.33 66.15 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.44 -0.644 . . . . 0.0 113.089 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -149.91 154.27 38.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.03 0.915 . . . . 0.0 110.579 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -73.96 146.21 44.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.996 0.518 . . . . 0.0 111.818 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -125.12 84.45 2.28 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.243 1.017 . . . . 0.0 108.814 175.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 7.5 m120 -55.16 128.39 33.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 116.045 -1.931 . . . . 0.0 112.756 -170.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.626 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.0 t -126.99 149.0 31.76 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 C-N-CA 113.486 -3.286 . . . . 0.0 115.848 168.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 35.6 t -160.28 170.7 20.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.554 1.542 . . . . 0.0 107.763 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.1 148.87 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 20.6 t -83.36 166.47 18.41 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 122.983 0.513 . . . . 0.0 110.634 177.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.86 11.69 10.41 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -85.15 152.84 59.14 Favored Pre-proline 0 CA--C 1.532 0.259 0 C-N-CA 123.46 0.704 . . . . 0.0 110.22 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -65.49 -46.57 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.888 2.392 . . . . 0.0 112.468 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -170.02 160.29 8.13 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.902 0.881 . . . . 0.0 109.751 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.402 ' HB ' ' HE2' ' A' ' 408' ' ' LYS . 69.8 mt -77.91 143.08 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 79.2 mtp -114.16 134.12 22.26 Favored Pre-proline 0 N--CA 1.454 -0.236 0 O-C-N 122.407 -0.183 . . . . 0.0 111.033 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.38 161.47 40.17 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.497 2.798 . . . . 0.0 109.282 174.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 159.76 -132.15 2.91 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -72.47 161.79 30.34 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.892 0.477 . . . . 0.0 110.021 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 92.0 p -149.3 168.78 22.4 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.341 0.656 . . . . 0.0 110.03 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -129.34 -1.25 5.05 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 75.49 -178.95 46.98 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 111.979 -0.448 . . . . 0.0 111.979 -178.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.79 159.43 42.88 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.162 0.985 . . . . 0.0 109.453 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -76.7 -9.28 58.56 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -120.62 24.93 10.05 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.611 0.764 . . . . 0.0 110.249 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.89 -152.97 9.34 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 68.0 m -133.01 -12.67 2.85 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 178.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 19.4 p -127.04 150.86 49.25 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.274 0.63 . . . . 0.0 111.924 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 83.2 p -99.8 4.74 45.44 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.334 0.653 . . . . 0.0 110.884 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -141.6 148.24 38.91 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.374 1.47 . . . . 0.0 113.574 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -151.08 156.15 40.45 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 118.274 0.488 . . . . 0.0 111.291 -176.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -127.96 137.08 52.12 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -129.92 -1.78 4.69 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -68.22 -30.59 69.69 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.643 0.377 . . . . 0.0 111.749 -174.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -91.19 -2.72 57.45 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.683 0.393 . . . . 0.0 111.418 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 46.3 t -96.3 151.31 19.64 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.821 0.449 . . . . 0.0 111.927 -176.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -90.97 5.3 49.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.874 0.47 . . . . 0.0 111.183 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.05 -22.3 65.64 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.678 0.391 . . . . 0.0 111.656 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -60.71 137.7 58.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 122.905 0.482 . . . . 0.0 109.917 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 481' ' ' ARG . 48.7 tpt85 -72.12 -24.75 61.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.16 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.269 51.8 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 88.6 p -61.19 -22.16 64.49 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -169.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.59 157.72 67.44 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.48 -23.8 75.11 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.876 2.384 . . . . 0.0 111.298 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -80.96 -31.78 34.7 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -76.97 -28.11 55.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -73.45 -21.38 60.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 122.652 0.381 . . . . 0.0 110.72 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -81.9 -12.97 58.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.879 0.472 . . . . 0.0 111.895 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -123.97 16.53 9.3 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.966 0.507 . . . . 0.0 110.676 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 149.17 48.58 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 111.41 -174.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -145.6 130.46 18.17 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 30.1 mm -140.53 137.54 36.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.082 0 C-N-CA 122.777 0.431 . . . . 0.0 110.153 -175.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -152.26 167.42 28.66 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.44 1.096 . . . . 0.0 109.624 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -64.74 157.61 73.38 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.63 148.61 92.63 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.37 2.047 . . . . 0.0 109.584 178.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.4 t -152.46 174.72 13.54 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -83.82 -7.66 59.4 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.2 t -86.76 140.24 16.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 112.328 173.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 14.4 tp -137.56 142.72 41.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -112.32 150.93 30.33 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.783 0.833 . . . . 0.0 109.406 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -146.46 160.22 42.37 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.456 0.646 . . . . 0.0 109.646 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -151.63 167.55 27.77 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 32.8 m120 53.28 55.71 8.4 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.612 0.365 . . . . 0.0 111.427 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.22 152.85 52.92 Favored Pre-proline 0 CA--C 1.531 0.217 0 C-N-CA 122.323 0.249 . . . . 0.0 110.454 177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.15 152.4 38.06 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.152 2.568 . . . . 0.0 112.157 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.78 -16.4 63.78 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.97 0.508 . . . . 0.0 112.203 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -122.06 24.62 9.45 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.615 0.766 . . . . 0.0 110.897 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.9 p -67.74 -13.23 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 -176.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.682 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.6 OUTLIER -54.3 -178.37 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -166.484 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.682 ' H ' HG22 ' A' ' 510' ' ' THR . 23.0 pt-20 -20.23 -42.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.6 mt-10 -56.15 -49.24 74.52 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 172.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -87.17 -27.04 23.26 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 122.034 2.197 . . . . 0.0 106.732 -173.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -64.95 -39.92 94.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -70.53 -44.42 67.55 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -75.31 -26.56 58.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.085 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 58.3 mt -71.6 -37.38 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.044 0 CA-C-N 118.858 0.754 . . . . 0.0 110.203 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 94.5 m -67.3 -29.97 69.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.897 -0.502 . . . . 0.0 111.026 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -73.85 -28.98 61.86 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -78.36 -11.51 59.95 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.98 -4.88 12.52 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.173 0.589 . . . . 0.0 111.55 -179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.8 3.87 60.57 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 123.572 0.606 . . . . 0.0 112.82 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.94 157.13 5.46 Favored 'Isoleucine or valine' 0 C--N 1.339 0.129 0 CA-C-N 117.831 0.815 . . . . 0.0 112.813 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.53 144.5 55.99 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.575 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 55.3 ptt85 -80.81 149.43 67.32 Favored Pre-proline 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.63 148.3 65.57 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 123.058 2.505 . . . . 0.0 110.311 177.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.7 t -85.64 -21.01 28.62 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 73.4 m -146.84 154.64 41.57 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 122.978 0.511 . . . . 0.0 110.786 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 76.8 t -144.72 145.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 123.649 0.779 . . . . 0.0 109.913 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -152.85 143.63 22.85 Favored 'General case' 0 C--N 1.337 0.049 0 C-N-CA 123.002 0.521 . . . . 0.0 109.994 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -138.62 150.64 23.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.057 0 C-N-CA 123.43 0.692 . . . . 0.0 112.13 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -154.85 -178.72 7.42 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -178.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 33.8 t -134.06 -177.76 4.72 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.307 1.043 . . . . 0.0 109.77 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 99.76 9.82 48.44 Favored Glycine 0 CA--C 1.527 0.826 0 CA-C-O 119.746 -0.474 . . . . 0.0 111.97 -177.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -125.67 -26.07 3.58 Favored 'General case' 0 C--N 1.338 0.101 0 CA-C-N 117.659 0.729 . . . . 0.0 112.5 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 41.3 t -164.52 155.09 14.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.812 0.445 . . . . 0.0 110.587 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -103.43 -8.05 20.48 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.038 0.535 . . . . 0.0 110.532 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -78.47 -38.42 41.06 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 122.723 0.409 . . . . 0.0 112.055 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 58.4 m -156.06 167.7 29.57 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 111.399 -171.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 37.5 t -83.8 167.52 17.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.644 0.778 . . . . 0.0 110.825 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -151.52 160.21 43.79 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 124.322 1.049 . . . . 0.0 108.616 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.05 -168.46 41.6 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.833 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -119.02 160.27 22.32 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.507 0.723 . . . . 0.0 110.827 -179.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 82.4 mt -138.06 161.76 35.92 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.268 1.427 . . . . 0.0 107.921 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -151.64 147.41 26.72 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.244 -0.285 . . . . 0.0 110.873 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -125.03 173.54 8.62 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.722 1.209 . . . . 0.0 112.723 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -74.68 -7.55 53.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 43.8 t -158.98 158.26 32.89 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 122.484 0.314 . . . . 0.0 111.119 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -68.05 -27.91 66.93 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.501 0.32 . . . . 0.0 110.532 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 85.3 p -77.08 -23.77 51.89 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.273 0.229 . . . . 0.0 110.839 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -76.82 -35.51 57.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.248 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -74.19 -28.49 61.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 122.187 -0.321 . . . . 0.0 110.353 174.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.4 tp -73.09 -42.98 62.42 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.061 0.544 . . . . 0.0 111.17 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -70.2 -35.3 73.83 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -178.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.82 -21.85 63.35 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 174.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.57 -39.19 88.36 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -70.07 -26.94 73.63 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.761 -0.466 . . . . 0.0 112.309 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.347 10.6 m-85 -102.16 -1.23 31.83 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 119.437 3.125 . . . . 0.0 119.437 179.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 60.4 mt -135.79 -4.59 2.23 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.828 1.195 . . . . 0.0 114.137 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.92 143.89 47.54 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 119.962 1.255 . . . . 0.0 109.094 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 58.87 15.41 3.85 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.369 1.068 . . . . 0.0 113.341 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -70.06 139.04 52.55 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -73.93 136.9 43.33 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.822 -0.549 . . . . 0.0 111.942 -175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 79.4 mtm -83.57 152.56 24.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.894 0.478 . . . . 0.0 110.676 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -71.97 168.19 18.54 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -146.55 121.22 5.32 Favored Pre-proline 0 N--CA 1.454 -0.264 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.9 -22.74 31.02 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.106 2.538 . . . . 0.0 113.306 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -158.71 -5.95 0.08 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 114.544 1.312 . . . . 0.0 114.544 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -73.92 158.98 52.57 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.828 0.74 . . . . 0.0 111.714 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.87 -21.28 21.41 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 124.058 3.172 . . . . 0.0 112.396 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -152.63 151.82 27.59 Favored Pre-proline 0 N--CA 1.456 -0.171 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.66 165.26 30.66 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 C-N-CA 123.933 3.089 . . . . 0.0 111.414 177.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -129.91 142.35 50.67 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 102.825 -3.028 . . . . 0.0 102.825 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.7 143.53 42.07 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 6.4 tt -89.05 152.22 21.8 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.601 1.16 . . . . 0.0 108.95 173.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . 0.405 ' HE2' " H1'" ' C' ' 2' ' ' ' C' . 0.1 OUTLIER -139.95 150.75 44.9 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.023 -0.423 . . . . 0.0 110.777 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.27 162.05 40.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 22.3 p -165.49 168.27 16.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -54.94 129.58 38.21 Favored 'General case' 0 N--CA 1.457 -0.09 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 39.7 t -81.16 148.57 29.51 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 t -114.04 8.21 17.0 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 169.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.98 158.91 21.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.068 0.947 . . . . 0.0 111.744 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -91.84 -3.41 56.1 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.489 -178.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -154.53 172.77 17.27 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.553 0.741 . . . . 0.0 110.541 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.97 23.36 1.37 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.972 0.909 . . . . 0.0 109.802 176.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.253 1.255 0 CA-C-O 117.427 -1.273 . . . . 0.0 110.515 -176.416 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.519 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.418 -2.878 1 O4'-C1'-N19 112.821 4.621 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C5'-C4'-C3' 110.261 -3.493 . 0.402 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.563 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.946 0 C3'-C2'-C1' 104.633 3.481 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.737 1 C5'-C4'-C3' 107.854 -5.097 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.745 1 O4'-C1'-N19 113.56 5.36 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.492 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.836 0 C5'-C4'-C3' 109.868 -3.754 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.405 " H1'" ' HE2' ' A' ' 576' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.753 0 O4'-C1'-N19 111.164 2.964 . 0.077 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.951 0 C3'-C2'-C1' 105.065 3.961 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.872 0 O4'-C1'-N19 110.796 2.596 . 0.122 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.644 1 C5'-C4'-C3' 108.592 -4.605 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.3 31.4 t80 . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 115.594 1.702 . . . . 0.0 115.594 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -69.42 173.69 36.21 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 112.387 -0.285 . . . . 0.0 112.387 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.7 179.6 4.08 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 124.772 3.648 . . . . 0.0 110.942 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -142.99 157.24 44.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.89 0.476 . . . . 0.0 110.765 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.97 158.93 34.5 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.514 0.725 . . . . 0.0 110.948 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -73.74 -4.39 34.27 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -158.08 147.91 15.33 Favored Pre-proline 0 N--CA 1.456 -0.131 0 C-N-CA 123.177 0.591 . . . . 0.0 110.035 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.27 -15.22 47.47 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.908 2.406 . . . . 0.0 110.322 174.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.5 t -91.26 154.79 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.583 0.753 . . . . 0.0 112.752 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.8 tt -140.41 152.07 45.42 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 125.152 1.381 . . . . 0.0 108.297 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 15.7 tpt -134.8 134.34 40.76 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.452 0.301 . . . . 0.0 111.033 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.8 p -129.91 152.71 37.78 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.069 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.495 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 3.7 m-85 -142.96 173.75 11.28 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -178.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 86.62 11.29 71.56 Favored Glycine 0 CA--C 1.527 0.808 0 O-C-N 122.242 -0.286 . . . . 0.0 112.48 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 41.2 mt -76.3 39.68 0.2 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.739 0.816 . . . . 0.0 110.998 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -74.34 18.67 0.15 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -136.98 156.27 48.65 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.943 0.497 . . . . 0.0 111.439 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 36.6 t -69.19 -15.38 63.38 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.52 0.728 . . . . 0.0 111.883 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -74.28 5.01 4.91 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 91.0 mmm -114.18 141.37 47.6 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.301 0.501 . . . . 0.0 110.782 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -162.36 168.02 22.83 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.568 1.147 . . . . 0.0 108.963 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 95.1 m -54.83 -32.11 60.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.902 0.481 . . . . 0.0 111.981 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.36 -38.6 60.0 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -66.39 -48.3 70.55 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -177.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.23 -49.41 84.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.422 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.268 1.4 m-85 -61.14 -56.87 15.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 178.025 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -57.44 -33.81 68.31 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 118.628 -1.229 . . . . 0.0 109.792 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.21 -64.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.572 0.5 OUTLIER -76.56 -5.52 48.01 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 176.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 50.5 t -74.77 -32.24 62.0 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.5 pp -63.3 -17.6 62.71 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.629 172.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -91.73 -8.83 45.8 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 168.73 -179.26 41.7 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 118.375 0.534 . . . . 0.0 112.455 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -80.67 129.99 34.84 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 122.599 -0.353 . . . . 0.0 110.958 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 0.8 OUTLIER -114.05 165.55 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.451 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -129.29 -63.34 0.95 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -154.42 158.81 40.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.295 0.952 . . . . 0.0 113.157 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . 0.41 ' HB ' ' CE2' ' A' ' 397' ' ' PHE . 7.5 p -138.52 150.94 24.09 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 C-N-CA 123.908 0.883 . . . . 0.0 110.267 -175.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -150.78 122.14 7.86 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.964 0.906 . . . . 0.0 110.417 -176.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.259 6.6 m-85 -80.51 155.43 27.01 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 177.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 23.0 mmt -100.26 115.96 31.13 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.783 0.433 . . . . 0.0 110.949 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -79.15 -14.26 59.21 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.69 0.396 . . . . 0.0 111.341 172.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 88.7 p -85.0 -5.48 59.35 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.322 0.649 . . . . 0.0 112.251 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -126.21 156.73 71.83 Favored Pre-proline 0 CA--C 1.529 0.153 0 C-N-CA 123.554 0.741 . . . . 0.0 109.903 -177.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.63 -15.06 40.77 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.189 2.593 . . . . 0.0 111.592 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 174.19 92.07 0.08 OUTLIER Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 177.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -153.99 159.72 41.75 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.38 166.7 32.65 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.276 0.56 . . . . 0.0 110.578 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 41.1 ttp -129.49 147.43 51.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.275 1.03 . . . . 0.0 109.065 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.67 157.05 20.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -137.17 133.83 35.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 26.3 mtm -153.02 177.96 10.22 Favored 'General case' 0 C--O 1.23 0.078 0 C-N-CA 123.934 0.894 . . . . 0.0 109.957 -173.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.09 118.64 10.13 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 171.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -72.3 -33.3 67.3 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -168.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -55.69 -86.21 0.02 OUTLIER Glycine 0 C--N 1.335 0.524 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -177.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -74.5 -28.53 61.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.81 -34.06 18.4 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.984 -174.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.4 t -88.76 -23.99 6.17 Favored 'Isoleucine or valine' 0 C--N 1.341 0.225 0 C-N-CA 118.828 -1.149 . . . . 0.0 109.47 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.83 -52.06 33.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.943 174.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -68.17 -32.7 73.13 Favored 'General case' 0 C--N 1.341 0.214 0 O-C-N 121.874 -0.516 . . . . 0.0 112.386 -176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.67 -34.19 75.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 118.721 0.691 . . . . 0.0 110.584 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.53 -12.69 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.31 0.644 . . . . 0.0 110.731 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 20.7 m -92.42 -21.24 20.31 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -128.6 -28.17 2.53 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.72 -15.16 7.99 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 120.486 1.494 . . . . 0.0 114.447 -172.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.646 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.63 100.82 2.38 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 116.83 2.159 . . . . 0.0 116.83 -167.59 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.624 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 12.1 m-80 76.84 21.95 1.14 Allowed 'General case' 0 N--CA 1.482 1.144 0 O-C-N 117.743 -3.098 . . . . 0.0 113.199 -161.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -81.03 163.13 23.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.873 -1.142 . . . . 0.0 108.769 167.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -82.62 140.94 32.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 26.9 ttt -159.7 138.7 10.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.09 0.556 . . . . 0.0 110.15 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.419 46.4 m-85 57.03 20.71 5.64 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.91 70.67 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -134.19 -167.58 1.98 Allowed 'General case' 0 C--O 1.231 0.092 0 C-N-CA 124.326 1.05 . . . . 0.0 108.866 177.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -129.71 143.08 50.65 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 12.8 ptm -118.02 84.59 2.2 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.991 0.517 . . . . 0.0 110.393 -177.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.624 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 2.7 m-20 -54.44 128.4 31.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.779 -173.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.646 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.441 2.3 t -126.19 154.38 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 113.286 -3.366 . . . . 0.0 115.848 168.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 45.8 t -162.99 166.79 23.34 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.477 1.511 . . . . 0.0 108.716 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 10.2 t -68.61 145.16 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 O-C-N 121.855 -0.528 . . . . 0.0 112.084 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 15.4 t -84.41 155.99 22.01 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.635 0.374 . . . . 0.0 111.144 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.416 ' HE3' ' C6 ' ' B' ' 2' ' ' ' C' . 16.5 ptpt -96.54 -9.62 29.1 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.51 -0.119 . . . . 0.0 110.711 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -76.31 148.51 80.77 Favored Pre-proline 0 N--CA 1.454 -0.264 0 C-N-CA 123.404 0.682 . . . . 0.0 110.658 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.22 -32.87 3.79 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.364 2.71 . . . . 0.0 111.617 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.81 157.89 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.286 0.634 . . . . 0.0 110.671 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 17.7 mt -82.58 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 49.7 mmm -93.9 119.78 66.54 Favored Pre-proline 0 N--CA 1.454 -0.246 0 C-N-CA 122.476 0.31 . . . . 0.0 110.382 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.49 154.47 45.13 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 123.213 2.609 . . . . 0.0 109.337 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 154.53 -113.06 0.55 Allowed Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.38 163.49 27.91 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.499 0.666 . . . . 0.0 111.905 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 14.7 t -157.37 160.12 38.12 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.44 1.096 . . . . 0.0 109.632 -177.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -130.07 0.73 4.72 Favored 'General case' 0 C--O 1.231 0.094 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.39 175.07 44.76 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 93.8 mt -143.41 157.03 44.79 Favored 'General case' 0 N--CA 1.458 -0.074 0 C-N-CA 124.235 1.014 . . . . 0.0 109.179 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -75.6 -8.04 55.77 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . 0.253 11.9 t0 -120.49 26.89 8.89 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 122.039 0.923 . . . . 0.0 112.665 175.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -173.51 -150.83 7.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 69.4 m -133.05 -16.9 2.45 Favored 'General case' 0 N--CA 1.458 -0.07 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 92.9 m -127.04 149.14 50.04 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.863 0.465 . . . . 0.0 111.368 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 92.9 p -89.77 7.19 38.15 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 110.137 173.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -139.77 148.64 42.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.993 1.317 . . . . 0.0 113.275 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -154.7 158.2 39.23 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.05 0.387 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -127.7 136.65 51.86 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -134.07 4.66 3.52 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -179.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 47.9 t -64.85 -22.01 66.91 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.127 0.571 . . . . 0.0 112.046 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -114.02 1.21 14.59 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.05 0.54 . . . . 0.0 111.777 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.9 m -75.73 149.81 37.96 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.023 0.44 . . . . 0.0 111.53 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -80.12 -11.14 59.78 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.157 0.583 . . . . 0.0 111.151 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -62.05 -23.93 66.78 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.155 0.582 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -60.89 128.68 37.68 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.832 0.453 . . . . 0.0 110.27 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -73.18 -33.64 65.54 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.349 61.0 m-85 -98.05 17.48 18.29 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 46.5 t -63.87 -21.95 66.69 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -173.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -135.19 150.5 72.95 Favored Pre-proline 0 C--O 1.23 0.071 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.6 -25.45 24.69 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.24 2.627 . . . . 0.0 111.412 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -80.03 -22.55 42.26 Favored 'General case' 0 CA--C 1.528 0.12 0 O-C-N 122.01 -0.431 . . . . 0.0 110.509 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -82.21 -41.65 20.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 172.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.26 -20.08 63.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.653 0.381 . . . . 0.0 111.858 -178.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.65 -19.71 48.45 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.472 0.309 . . . . 0.0 111.759 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -123.97 2.25 8.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -61.44 156.34 19.5 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.482 0.583 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -140.03 137.13 34.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -175.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 32.3 mm -141.12 144.02 27.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 C-N-CA 123.595 0.758 . . . . 0.0 109.119 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -147.93 167.87 23.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.554 0.741 . . . . 0.0 111.086 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -63.0 155.36 73.07 Favored Pre-proline 0 N--CA 1.455 -0.196 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 172.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -66.01 135.49 41.0 Favored 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.191 1.927 . . . . 0.0 108.456 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.7 t -154.12 173.71 15.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.77 0.428 . . . . 0.0 110.076 -172.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -83.79 -8.77 59.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.7 -0.19 . . . . 0.0 111.161 -178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.64 138.04 20.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.2 tp -139.18 151.22 46.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -123.02 149.37 44.44 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 123.771 0.828 . . . . 0.0 108.906 -178.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -143.99 159.13 43.13 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -152.55 167.76 27.77 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.363 -2.458 . . . . 0.0 104.363 -176.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 60.61 57.53 2.71 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.174 0.59 . . . . 0.0 112.231 -173.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -136.08 122.46 14.02 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-O 119.442 -0.314 . . . . 0.0 111.186 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.67 164.1 1.06 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.944 3.096 . . . . 0.0 113.279 172.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.42 -17.3 64.18 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.887 0.875 . . . . 0.0 112.062 -175.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -97.93 3.98 49.55 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 47.0 t -73.07 -18.17 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.3 m -55.38 -177.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 117.638 -1.172 . . . . 0.0 113.813 -165.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 510' ' ' THR . 22.9 pt-20 -18.84 -44.53 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.254 1.822 . . . . 0.0 114.834 -169.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 510' ' ' THR . 97.0 mt-10 -57.06 -48.23 79.05 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 173.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -87.64 -28.36 21.9 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 121.968 2.167 . . . . 0.0 106.323 -173.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -61.88 -35.81 79.42 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -75.84 -42.72 48.83 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.07 -22.3 42.42 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.477 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 61.6 mt -75.58 -45.01 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.126 0 CA-C-N 118.417 0.553 . . . . 0.0 110.648 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 30.7 p -68.32 -32.11 72.01 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.045 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -64.77 -39.28 93.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.834 0.349 . . . . 0.0 111.924 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.5 tp10 -71.39 -28.58 64.13 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.584 0.353 . . . . 0.0 111.272 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.75 -4.74 59.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.233 0.613 . . . . 0.0 111.691 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 78.6 27.85 56.31 Favored Glycine 0 CA--C 1.527 0.796 0 CA-C-O 119.829 -0.429 . . . . 0.0 112.219 175.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 6.0 p -129.73 152.58 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 C-N-CA 123.263 0.625 . . . . 0.0 112.027 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -68.64 152.93 44.69 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 121.203 0.525 . . . . 0.0 111.802 -175.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -82.24 156.23 69.14 Favored Pre-proline 0 CA--C 1.529 0.17 0 C-N-CA 123.81 0.844 . . . . 0.0 110.607 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.24 153.21 77.93 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.261 2.641 . . . . 0.0 111.108 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.2 t -84.78 -15.49 44.78 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 22.8 t -153.5 160.85 42.63 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.37 149.37 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 C-N-CA 123.311 0.645 . . . . 0.0 109.491 -176.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -147.07 143.91 28.68 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 124.103 0.961 . . . . 0.0 108.816 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 4.7 t -138.83 143.2 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.058 0 C-N-CA 122.877 0.471 . . . . 0.0 111.998 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -152.89 -175.23 5.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 88.8 p -146.12 -171.5 3.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.886 0.874 . . . . 0.0 110.28 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 102.2 -10.18 56.59 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 123.97 0.795 . . . . 0.0 111.908 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -89.87 -27.22 20.05 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 117.597 0.699 . . . . 0.0 111.648 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 83.5 p -165.83 163.86 18.72 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.447 0.699 . . . . 0.0 109.581 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -97.04 -4.21 40.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.716 0.406 . . . . 0.0 110.914 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.63 -40.6 48.77 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 89.2 p -163.21 170.6 17.5 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.14 0.495 . . . . 0.0 111.052 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.0 p -83.27 174.2 10.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.33 0.652 . . . . 0.0 110.186 177.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.9 p -153.74 162.41 41.26 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.35 -170.5 43.34 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.057 -177.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -119.08 160.39 22.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.484 0.713 . . . . 0.0 110.288 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -138.66 161.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.932 1.293 . . . . 0.0 108.367 177.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -150.75 148.73 28.9 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.28 -0.262 . . . . 0.0 111.099 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 21.3 m-90 -127.87 173.19 10.2 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.715 1.206 . . . . 0.0 112.343 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -75.19 -10.36 59.4 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.617 0.367 . . . . 0.0 110.459 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 41.6 t -157.93 160.73 37.9 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 121.735 -0.603 . . . . 0.0 111.118 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -74.1 -22.34 59.52 Favored 'General case' 0 CA--C 1.527 0.089 0 O-C-N 122.386 -0.196 . . . . 0.0 110.942 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 88.3 p -77.78 -27.29 50.19 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -71.51 -35.93 70.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.4 56.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 47.0 tp -78.23 -41.73 33.37 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.398 0.279 . . . . 0.0 111.409 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -68.59 -39.04 81.09 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 1.2 m -67.7 -28.42 67.66 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 3.4 tt -71.22 -36.88 72.02 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -60.19 -32.04 75.14 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 119.632 -0.538 . . . . 0.0 111.831 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.326 9.8 m-85 -100.69 -14.5 18.07 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 119.114 3.005 . . . . 0.0 119.114 177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.69 -14.53 14.79 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.972 0.806 . . . . 0.0 112.031 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -70.09 140.93 52.81 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.397 0.999 . . . . 0.0 109.073 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 55.47 20.29 3.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.673 1.189 . . . . 0.0 112.856 -178.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -68.35 135.57 52.02 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -75.98 130.93 39.18 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.121 -0.362 . . . . 0.0 111.492 -176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 61.6 mtm -100.95 152.67 20.28 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 123.145 0.578 . . . . 0.0 111.421 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -64.76 160.25 20.56 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 169.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -149.89 119.03 3.77 Favored Pre-proline 0 CA--C 1.532 0.257 0 O-C-N 122.281 -0.262 . . . . 0.0 111.184 -176.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -81.28 -16.66 9.48 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.395 2.73 . . . . 0.0 111.956 175.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -87.19 -5.15 59.08 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -175.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . 177.59 167.81 36.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -72.2 -22.31 22.45 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.775 2.983 . . . . 0.0 111.662 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -88.77 139.05 29.33 Favored Pre-proline 0 N--CA 1.455 -0.202 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -79.58 167.67 20.6 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 123.757 2.971 . . . . 0.0 111.946 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -128.83 142.35 51.0 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 170.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.281 0.6 OUTLIER -85.99 137.95 32.34 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -175.805 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.0 134.99 37.72 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.75 149.52 50.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 118.483 0.583 . . . . 0.0 110.574 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.53 162.49 39.93 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.864 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 21.9 p -163.73 170.82 16.45 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.398 0.679 . . . . 0.0 110.909 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -56.12 125.09 20.14 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.414 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 37.2 t -80.81 151.97 28.48 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.2 t -114.64 7.09 15.91 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.41 1.084 . . . . 0.0 113.767 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.83 163.95 20.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.148 0.979 . . . . 0.0 111.96 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -97.69 -2.84 40.48 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.608 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -154.55 170.27 21.87 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.518 0.727 . . . . 0.0 110.17 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.88 23.55 1.38 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.193 0.597 . . . . 0.0 110.45 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 117.627 -1.177 . . . . 0.0 110.74 -176.401 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.495 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.716 1 O4'-C1'-N19 112.464 4.264 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.416 ' C6 ' ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 O4'-C1'-N19 111.819 3.619 . 0.403 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.729 0 C3'-C2'-C1' 104.851 3.724 . 0.231 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.904 1 C5'-C4'-C3' 108.751 -4.499 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.956 1 O4'-C1'-N19 112.286 4.086 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.558 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.813 0 C5'-C4'-C3' 109.997 -3.668 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.972 0 C5'-C4'-C3' 110.578 -3.281 . 0.049 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.005 0 C3'-C2'-C1' 104.174 2.971 . 0.01 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.414 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 O4'-C1'-N19 110.936 2.736 . 0.24 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.863 1 C5'-C4'-C3' 108.05 -4.967 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.272 21.8 t80 . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.83 171.44 43.59 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -70.42 176.21 7.59 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.303 3.336 . . . . 0.0 110.848 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -146.57 159.8 42.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.311 0.645 . . . . 0.0 110.352 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -70.73 157.41 38.08 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.585 0.354 . . . . 0.0 111.234 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -79.62 -3.03 45.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.111 0.564 . . . . 0.0 110.544 -177.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 47.1 t -155.97 151.13 21.1 Favored Pre-proline 0 CA--C 1.532 0.267 0 O-C-N 121.498 -0.751 . . . . 0.0 111.341 -177.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.29 -4.3 3.95 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.473 3.449 . . . . 0.0 114.03 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 451' ' ' SER . 6.5 m -128.47 165.77 27.26 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.95 0.881 . . . . 0.0 109.892 -174.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.65 159.57 41.96 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.937 1.695 . . . . 0.0 107.733 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 24.6 ttt -143.59 138.89 29.38 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.538 0.608 . . . . 0.0 111.145 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -121.19 154.44 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -175.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.522 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 4.5 m-85 -142.44 171.09 14.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 85.1 13.13 72.23 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 122.141 -0.35 . . . . 0.0 112.302 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.28 28.34 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.747 0.819 . . . . 0.0 111.581 178.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -64.6 -26.33 68.36 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.424 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.7 pm0 -76.84 149.44 36.17 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.064 0.459 . . . . 0.0 110.996 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 90.8 p -70.58 -6.73 38.73 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.615 0.766 . . . . 0.0 112.646 -176.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -77.95 -14.34 59.57 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.954 0.501 . . . . 0.0 112.021 -176.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 80.3 mmm -86.05 154.29 21.52 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.034 0.379 . . . . 0.0 111.23 -178.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -164.0 164.34 23.13 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.315 1.046 . . . . 0.0 108.509 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.0 p -64.03 -29.77 70.89 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.034 -0.416 . . . . 0.0 111.978 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.02 -26.86 36.09 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -70.96 -50.79 30.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.435 0.636 . . . . 0.0 109.606 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.15 -47.47 92.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 406' ' ' VAL 0.264 1.3 m-85 -63.25 -52.35 62.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 178.06 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -59.42 -33.86 71.77 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 120.16 1.346 . . . . 0.0 109.458 -172.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 15.0 t -62.48 -61.88 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.561 0.8 OUTLIER -76.51 -4.98 45.57 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 176.216 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 52.9 t -75.26 -32.57 61.11 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.6 pp -62.41 -19.55 63.56 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.561 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -88.43 -9.31 52.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 116.919 2.192 . . . . 0.0 116.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 159.12 178.29 32.99 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 118.298 0.499 . . . . 0.0 112.234 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -68.51 140.21 55.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.435 ' HB ' ' CE1' ' A' ' 397' ' ' PHE . 18.2 m -114.01 165.46 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.918 1.287 . . . . 0.0 109.339 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -137.47 -60.71 0.66 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.81 154.7 37.78 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 118.738 0.699 . . . . 0.0 112.855 -175.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.9 146.72 19.73 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 C-N-CA 123.181 0.592 . . . . 0.0 109.976 176.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -153.2 133.07 13.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.632 0.373 . . . . 0.0 110.555 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.271 11.8 m-85 -80.38 149.6 30.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 37.7 mmt -75.01 131.95 40.99 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.135 0.493 . . . . 0.0 111.553 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -79.24 -25.5 42.59 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.879 0.871 . . . . 0.0 111.827 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 94.8 p -101.94 -6.78 23.06 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -113.89 152.74 45.92 Favored Pre-proline 0 CA--C 1.529 0.171 0 CA-C-N 118.507 0.594 . . . . 0.0 110.193 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -72.34 -15.9 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.463 2.776 . . . . 0.0 112.168 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 179.84 91.3 0.08 OUTLIER Glycine 0 C--N 1.337 0.611 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -158.84 159.91 35.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.639 0.775 . . . . 0.0 109.308 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.11 142.04 18.07 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.747 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 19.6 ptm -91.39 150.43 21.28 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.4 t -138.86 151.28 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.558 0.743 . . . . 0.0 112.13 -173.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -131.89 132.82 43.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 84.9 mtp -155.2 172.91 17.38 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 123.463 0.705 . . . . 0.0 109.691 -171.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -65.88 112.07 3.59 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.264 -2.125 . . . . 0.0 105.264 169.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -72.46 -33.41 67.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -166.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -54.74 -87.42 0.01 OUTLIER Glycine 0 CA--C 1.52 0.351 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -74.52 -27.3 60.48 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -88.11 -34.39 17.92 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.798 -174.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 96.6 t -85.92 -25.85 6.47 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 C-N-CA 118.525 -1.27 . . . . 0.0 108.576 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -63.89 -52.63 59.06 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.316 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -68.91 -31.89 71.13 Favored 'General case' 0 N--CA 1.457 -0.088 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -65.95 -34.58 78.43 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.559 0.618 . . . . 0.0 110.219 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 41.5 mt -77.92 -13.98 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 123.463 0.705 . . . . 0.0 110.926 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 9.9 m -91.97 -22.03 20.22 Favored 'General case' 0 CA--C 1.528 0.102 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.46 -20.24 3.32 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -169.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 63.9 mt -134.48 -14.56 2.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.625 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.67 101.02 2.44 Favored 'General case' 0 C--O 1.198 -1.622 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 -169.368 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.596 ' CA ' ' HA ' ' A' ' 447' ' ' ASN . 7.3 m-80 76.87 22.06 1.12 Allowed 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.012 -2.93 . . . . 0.0 112.491 -161.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -85.79 162.93 18.45 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -78.72 141.94 37.48 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 27.8 ttt -162.03 137.85 7.61 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.262 0.625 . . . . 0.0 109.912 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.411 49.4 m-85 56.76 28.87 14.98 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.96 9.26 86.79 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 61.7 mm-40 -134.0 -167.67 1.99 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.036 1.334 . . . . 0.0 108.7 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -138.17 143.91 40.49 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.36 105.3 8.98 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.596 ' HA ' ' CA ' ' A' ' 438' ' ' ASN . 23.5 m-20 -64.08 132.02 49.25 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 115.709 -2.091 . . . . 0.0 111.729 -173.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.625 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.448 2.1 t -125.75 151.8 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 113.229 -3.388 . . . . 0.0 115.567 169.258 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.6 t -163.99 170.03 17.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.472 1.109 . . . . 0.0 108.568 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 5.5 t -69.85 144.31 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . 0.449 ' HB3' HG23 ' A' ' 380' ' ' VAL . 15.9 t -87.66 153.88 21.03 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.057 0.543 . . . . 0.0 110.822 177.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.428 ' HE3' " H2'" ' B' ' 2' ' ' ' C' . 21.4 pttp -101.89 1.37 36.83 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -73.87 156.21 88.26 Favored Pre-proline 0 N--CA 1.454 -0.233 0 C-N-CA 123.272 0.629 . . . . 0.0 110.036 176.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -75.87 -42.69 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.667 2.245 . . . . 0.0 111.019 176.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -171.04 164.7 7.51 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 124.196 0.998 . . . . 0.0 109.457 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.09 137.72 21.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.115 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 7.8 mmm -107.33 132.6 20.84 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 122.542 0.337 . . . . 0.0 110.691 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.1 158.61 45.39 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.228 2.619 . . . . 0.0 109.105 173.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 155.82 -133.1 3.59 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.368 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -72.55 158.79 35.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.599 0.76 . . . . 0.0 110.75 -176.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.2 p -151.2 169.45 21.86 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.433 0.693 . . . . 0.0 109.766 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -122.65 1.68 9.47 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 80.51 -175.14 54.95 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.35 162.39 36.57 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 124.387 1.075 . . . . 0.0 109.165 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 11.0 pm0 -70.08 -22.01 63.09 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -120.49 13.41 11.76 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -159.04 167.13 34.8 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 121.986 -0.446 . . . . 0.0 112.17 -176.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 t -86.35 -29.79 22.7 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.782 0.433 . . . . 0.0 111.777 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 87.4 m -127.06 151.52 48.5 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.008 0.523 . . . . 0.0 111.639 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 84.4 p -82.24 7.27 14.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.262 0.625 . . . . 0.0 110.728 175.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -134.04 147.5 50.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.312 1.445 . . . . 0.0 114.824 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -152.63 153.45 33.36 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.883 0.473 . . . . 0.0 110.315 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . 0.256 0.1 OUTLIER -133.98 145.73 49.78 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -127.33 10.78 6.83 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 34.6 t -65.33 -22.59 66.84 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.259 0.624 . . . . 0.0 111.91 -174.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -114.05 2.04 14.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.045 0.538 . . . . 0.0 111.637 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -77.32 146.51 36.71 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.766 0.317 . . . . 0.0 111.372 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -79.25 -8.21 58.86 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.393 0.277 . . . . 0.0 110.87 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -63.08 -21.66 66.33 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -59.04 123.35 16.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.566 0.346 . . . . 0.0 110.125 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -80.97 -32.6 34.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -176.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.285 55.1 m-85 -97.96 14.26 27.94 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 89.4 p -74.61 -6.67 49.89 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.28 149.83 69.05 Favored Pre-proline 0 C--O 1.23 0.059 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -71.4 -24.72 22.34 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 123.235 2.623 . . . . 0.0 111.301 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -81.37 -23.97 37.35 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.066 0.394 . . . . 0.0 110.751 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -82.84 -41.81 18.59 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 173.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -64.21 -18.18 64.27 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.462 0.305 . . . . 0.0 111.579 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.11 -18.9 52.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.757 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -124.09 -2.54 8.14 Favored 'General case' 0 C--N 1.339 0.152 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.54 152.6 41.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.872 0.76 . . . . 0.0 110.772 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.548 ' NH1' " H2'" ' C' ' 4' ' ' ' C' . 6.4 ptp180 -150.91 138.61 19.75 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 65.9 mt -139.78 145.66 26.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 123.829 0.851 . . . . 0.0 108.909 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -145.3 173.48 11.93 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.6 0.76 . . . . 0.0 110.523 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -56.99 154.3 19.79 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.088 0.555 . . . . 0.0 109.558 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -63.5 148.75 92.34 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.701 2.267 . . . . 0.0 110.097 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.1 t -152.57 167.39 29.01 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.804 -174.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.8 p-10 -83.66 -0.69 51.73 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 122.315 -0.241 . . . . 0.0 111.051 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 3.0 t -97.57 134.53 35.28 Favored 'Isoleucine or valine' 0 C--O 1.231 0.084 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -117.51 157.76 25.73 Favored 'General case' 0 N--CA 1.458 -0.051 0 C-N-CA 123.865 0.866 . . . . 0.0 109.136 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -129.37 136.97 50.67 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.166 0.986 . . . . 0.0 108.37 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -125.82 158.07 35.94 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -177.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -147.63 165.52 30.16 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 103.656 -2.72 . . . . 0.0 103.656 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . 0.408 HD21 " H5'" ' C' ' 2' ' ' ' C' . 17.5 m120 57.95 57.42 4.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.882 0.473 . . . . 0.0 111.864 -175.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -126.55 152.56 74.63 Favored Pre-proline 0 N--CA 1.454 -0.268 0 C-N-CA 123.345 0.658 . . . . 0.0 110.322 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.413 ' HD3' ' SD ' ' A' ' 564' ' ' MET . 74.0 Cg_endo -68.72 162.59 40.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.728 2.286 . . . . 0.0 110.658 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.46 -16.56 63.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.202 0.601 . . . . 0.0 111.317 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -112.54 22.26 14.79 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.329 0.651 . . . . 0.0 111.388 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 4.3 p -65.93 -15.12 18.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -176.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.88 -177.23 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 117.793 -1.098 . . . . 0.0 113.863 -165.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.615 ' H ' HG22 ' A' ' 510' ' ' THR . 23.5 pt-20 -27.32 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -169.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.9 mt-10 -57.57 -47.86 80.93 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 117.545 -1.217 . . . . 0.0 114.244 170.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -86.0 -27.67 24.68 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-N 122.287 2.312 . . . . 0.0 106.346 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.52 -33.53 75.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.663 1.356 . . . . 0.0 114.663 176.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -77.52 -41.19 40.1 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.13 -28.45 57.44 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.015 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 69.9 mt -73.32 -40.22 56.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.115 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.42 -30.17 70.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.83 -43.7 71.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -68.86 -22.08 64.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 O-C-N 122.17 -0.331 . . . . 0.0 111.837 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.88 -5.23 48.44 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.923 0.489 . . . . 0.0 111.321 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.08 4.73 60.18 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-O 119.655 -0.525 . . . . 0.0 113.782 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.02 162.44 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 CA-C-N 118.154 0.977 . . . . 0.0 112.98 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -73.34 143.86 46.74 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 174.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -71.92 149.3 92.47 Favored Pre-proline 0 CA--C 1.529 0.172 0 C-N-CA 122.823 0.449 . . . . 0.0 111.193 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.38 155.9 62.88 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.622 2.881 . . . . 0.0 110.733 177.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.8 t -86.0 -17.95 33.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.4 t -154.8 156.79 36.89 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.515 0.198 . . . . 0.0 110.995 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 96.5 t -145.06 145.6 20.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 123.879 0.872 . . . . 0.0 110.199 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -146.92 145.9 29.95 Favored 'General case' 0 C--N 1.338 0.076 0 C-N-CA 123.252 0.621 . . . . 0.0 109.833 175.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 7.9 t -143.7 144.55 23.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -177.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -153.78 -175.43 5.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 91.8 p -133.59 -178.99 5.25 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.543 0.737 . . . . 0.0 110.756 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 97.43 -7.22 63.69 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.862 0.744 . . . . 0.0 112.375 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -86.69 -34.84 19.6 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.715 0.757 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 39.7 t -167.18 158.39 12.0 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.963 0.505 . . . . 0.0 110.265 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -96.89 -7.97 32.03 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.2 -28.85 19.7 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.433 0.693 . . . . 0.0 111.549 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 87.9 p -160.56 155.91 24.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 121.245 0.545 . . . . 0.0 112.044 -178.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 34.5 t -84.22 171.98 12.29 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 177.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 66.7 m -146.75 163.64 35.32 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.631 1.172 . . . . 0.0 109.455 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 175.98 -173.11 46.05 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.61 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -122.39 160.39 25.55 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.597 0.759 . . . . 0.0 110.828 -177.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 70.4 mt -139.54 158.94 43.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.835 1.254 . . . . 0.0 108.48 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -150.76 147.5 27.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.936 0.335 . . . . 0.0 111.569 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -122.81 169.27 11.28 Favored 'General case' 0 C--N 1.338 0.073 0 C-N-CA 124.867 1.267 . . . . 0.0 112.633 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -76.42 -8.24 56.72 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.887 0.475 . . . . 0.0 110.861 -176.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 33.9 t -156.26 158.44 37.52 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 121.708 -0.62 . . . . 0.0 111.165 -178.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.01 -30.01 67.22 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.384 0.273 . . . . 0.0 111.192 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 71.8 m -79.34 -26.33 42.14 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 110.483 -0.192 . . . . 0.0 110.483 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -72.52 -30.98 64.97 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 121.042 0.449 . . . . 0.0 111.355 174.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.92 -28.04 55.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.864 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 51.6 tp -79.93 -35.2 38.11 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.439 0.296 . . . . 0.0 111.455 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -74.41 -38.35 63.1 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.725 -0.609 . . . . 0.0 109.414 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.263 0.3 OUTLIER -72.45 -21.41 61.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 175.38 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.64 -36.05 78.08 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 170.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -64.42 -43.96 95.99 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.253 6.6 m-85 -85.64 -18.63 32.69 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -106.56 -12.76 15.51 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.935 0.789 . . . . 0.0 112.396 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -74.98 141.05 44.03 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.239 0.927 . . . . 0.0 109.269 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 55.07 19.24 2.67 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.294 1.037 . . . . 0.0 112.636 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.253 39.9 t80 -73.24 139.2 46.05 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -72.5 125.42 27.39 Favored 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 122.309 0.243 . . . . 0.0 110.868 -176.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . 0.413 ' SD ' ' HD3' ' A' ' 506' ' ' PRO . 75.3 mtm -83.52 152.69 24.78 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.686 0.395 . . . . 0.0 111.926 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -64.23 157.64 25.29 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 172.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -146.85 58.69 4.52 Favored Pre-proline 0 CA--C 1.533 0.29 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -177.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -69.69 1.59 4.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.88 3.053 . . . . 0.0 111.947 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -142.38 24.68 1.92 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.372 0.669 . . . . 0.0 110.626 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -150.88 154.64 25.71 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -72.6 -22.3 21.1 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.882 3.055 . . . . 0.0 111.987 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -151.81 150.46 26.22 Favored Pre-proline 0 N--CA 1.455 -0.191 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.0 160.12 43.53 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.948 3.099 . . . . 0.0 111.717 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -129.92 142.39 50.66 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 102.677 -3.083 . . . . 0.0 102.677 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.258 0.7 OUTLIER -77.37 138.37 39.27 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 179.078 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.3 tt -83.14 151.85 25.54 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.42 150.42 47.63 Favored 'General case' 0 CA--C 1.522 -0.11 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.546 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -157.25 165.15 36.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 111.184 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 28.8 p -158.99 170.37 22.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.45 0.7 . . . . 0.0 109.713 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -56.48 125.71 23.26 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 177.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 38.1 t -86.64 152.42 22.59 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -169.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 t -111.7 10.13 20.98 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.34 14.18 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 124.046 0.938 . . . . 0.0 111.836 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.8 mm-40 -92.01 -3.92 55.19 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.98 178.36 3.44 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.636 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -142.76 32.01 1.43 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.349 0.26 . . . . 0.0 111.63 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.43 -1.271 . . . . 0.0 110.701 -178.959 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.522 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.73 0 O4'-C1'-N19 112.002 3.802 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.428 " H2'" ' HE3' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.42 -2.732 0 C5'-C4'-C3' 110.867 -3.088 . 0.346 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.594 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.793 1 O4'-C1'-N19 112.947 4.747 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.842 0 C5'-C4'-C3' 110.844 -3.104 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . 0.421 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.806 1 O4'-C1'-N19 112.865 4.665 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.527 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.649 0 C5'-C4'-C3' 109.807 -3.796 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.408 " H5'" HD21 ' A' ' 504' ' ' ASN . . . . . . . . 0 O4'--C4' 1.42 -2.769 0 O4'-C1'-N19 111.404 3.204 . 0.076 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.887 0 C3'-C2'-C1' 104.742 3.602 . 0.062 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.548 " H2'" ' NH1' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.422 -2.572 1 O4'-C1'-N19 112.719 4.519 . 0.049 4b . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.576 1 C5'-C4'-C3' 107.371 -5.419 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.299 42.5 t80 . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 155.81 173.44 24.45 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.75 165.96 30.38 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 124.025 3.15 . . . . 0.0 109.825 176.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . 0.401 ' HA ' ' HA2' ' A' ' 426' ' ' GLY . 41.1 p-80 -154.63 157.91 38.9 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.321 0.581 . . . . 0.0 112.182 -178.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.64 166.24 23.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.95 0.9 . . . . 0.0 111.391 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.22 -8.28 53.89 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.8 t -159.49 147.35 13.28 Favored Pre-proline 0 N--CA 1.454 -0.227 0 C-N-CA 122.725 0.41 . . . . 0.0 110.985 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -13.75 36.16 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 123.565 2.843 . . . . 0.0 110.965 173.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -86.22 146.43 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.4 tt -134.88 155.04 51.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.5 1.12 . . . . 0.0 108.488 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.31 134.83 34.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -174.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.07 150.46 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.097 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.426 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 7.5 m-85 -139.96 176.31 8.85 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 105.254 -2.128 . . . . 0.0 105.254 -177.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 81.74 11.84 82.31 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 116.417 -0.356 . . . . 0.0 112.426 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 62.7 mt -79.29 22.76 0.41 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.652 0.726 . . . . 0.0 112.131 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -65.17 -25.64 67.82 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -175.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.439 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.1 pm0 -66.92 157.06 34.19 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.395 0.617 . . . . 0.0 111.599 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 81.6 p -79.05 27.39 0.24 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.75 1.22 . . . . 0.0 112.23 -172.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.87 4.23 4.15 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.294 0.638 . . . . 0.0 112.696 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 39.9 mmm -102.37 141.89 34.46 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.729 0.3 . . . . 0.0 110.201 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -154.27 152.64 30.53 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.211 0.604 . . . . 0.0 109.47 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.3 p -57.68 -37.07 72.83 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -71.3 -38.47 71.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.247 0.476 . . . . 0.0 112.184 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -76.02 -45.58 33.76 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.147 0.579 . . . . 0.0 112.233 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.61 -42.36 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -75.91 -29.93 58.59 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.764 -170.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 0.4 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 2.0 p30 -76.97 -30.88 56.18 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.893 1.224 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.54 -55.75 19.36 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 N-CA-C 106.405 -1.702 . . . . 0.0 106.405 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.541 5.4 p90 -76.6 -4.91 45.41 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 173.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 49.9 t -74.63 -30.52 61.68 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.924 -0.485 . . . . 0.0 110.624 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 2.0 pp -62.34 -16.3 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.301 -0.559 . . . . 0.0 111.152 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -87.53 -7.33 57.7 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.55 -172.28 44.84 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.226 -178.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -85.03 121.04 27.23 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.082 0.553 . . . . 0.0 109.816 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.2 m -114.11 165.5 9.07 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -130.16 -59.92 1.03 Allowed 'General case' 0 C--N 1.339 0.144 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -144.14 169.77 17.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.859 1.208 . . . . 0.0 112.51 -177.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.0 p -147.24 144.13 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 125.057 1.343 . . . . 0.0 108.24 175.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -154.39 124.16 6.67 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 117.961 0.346 . . . . 0.0 111.438 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.263 5.9 m-85 -72.68 155.24 40.2 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 116.976 2.213 . . . . 0.0 116.976 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 35.9 mmt -84.92 128.73 34.75 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.271 0.629 . . . . 0.0 111.64 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -18.29 53.29 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 84.1 p -101.95 1.59 36.91 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -126.89 152.03 74.74 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 118.342 0.519 . . . . 0.0 110.623 -175.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.0 -15.6 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.535 2.823 . . . . 0.0 111.441 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.63 94.96 0.1 OUTLIER Glycine 0 C--N 1.338 0.66 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -160.54 160.0 31.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.651 0.78 . . . . 0.0 109.208 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -160.15 144.67 14.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 77.6 mtp -84.7 154.2 22.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.712 0.805 . . . . 0.0 109.335 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 38.1 t -147.48 152.12 13.16 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -134.21 139.88 46.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.114 -0.366 . . . . 0.0 110.06 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.4 ptp -164.14 172.49 13.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.273 1.029 . . . . 0.0 110.047 -174.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -63.33 126.77 28.55 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -72.91 -34.03 66.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -169.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 375' ' ' HIS . . . -58.68 -85.79 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -178.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -64.15 -37.42 87.41 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.46 -35.96 17.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.401 -0.809 . . . . 0.0 112.876 -171.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 59.2 t -83.18 -28.29 7.87 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 CA-C-N 120.242 1.383 . . . . 0.0 109.153 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -68.71 -47.29 66.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.753 177.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -68.12 -36.87 80.43 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -176.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.69 77.94 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.944 0.793 . . . . 0.0 109.814 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 46.9 mt -76.48 -14.81 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 122.826 0.45 . . . . 0.0 110.85 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 55.4 m -97.24 -17.42 19.84 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -130.27 -26.13 2.37 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 116.29 1.959 . . . . 0.0 116.29 -169.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 5.2 mp -134.61 -11.09 2.4 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 120.532 1.515 . . . . 0.0 114.27 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.633 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.96 101.18 2.62 Favored 'General case' 0 C--O 1.198 -1.615 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 -168.091 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 7.4 m-80 77.19 21.47 1.08 Allowed 'General case' 0 N--CA 1.483 1.221 0 O-C-N 117.381 -3.325 . . . . 0.0 112.763 -163.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.21 159.67 28.4 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.536 -0.728 . . . . 0.0 110.002 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -74.33 136.79 42.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 115.675 1.731 . . . . 0.0 115.675 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.4 ttt -157.96 140.9 14.94 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.351 0.661 . . . . 0.0 109.531 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 59.44 17.5 6.03 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 80.73 10.22 85.42 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -174.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -132.39 -162.26 1.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.509 1.523 . . . . 0.0 108.31 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -135.36 146.97 48.91 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 122.646 0.378 . . . . 0.0 110.812 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.63 99.93 5.34 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 176.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -65.22 131.33 46.22 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 115.746 -2.073 . . . . 0.0 112.487 -171.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.633 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.449 2.1 t -125.91 152.13 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 112.62 -3.632 . . . . 0.0 115.809 168.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 36.8 t -162.96 171.26 16.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.778 1.231 . . . . 0.0 108.462 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 4.2 p -76.18 146.95 8.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 27.2 t -86.33 156.86 20.05 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.066 0.547 . . . . 0.0 111.01 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -92.55 -8.51 44.17 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 111.179 0.066 . . . . 0.0 111.179 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -77.49 150.43 79.55 Favored Pre-proline 0 CA--C 1.529 0.144 0 C-N-CA 123.458 0.703 . . . . 0.0 110.637 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.58 -32.95 1.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.411 2.74 . . . . 0.0 112.484 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -168.03 159.89 11.57 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.364 0.666 . . . . 0.0 110.343 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 39.1 mt -91.09 122.68 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 39.1 mmm -76.11 160.48 78.12 Favored Pre-proline 0 N--CA 1.456 -0.158 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 170.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -49.11 117.56 2.92 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.752 2.301 . . . . 0.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -78.49 135.44 15.83 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 -169.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -78.32 164.13 25.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 168.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 33.4 t -143.78 159.12 43.07 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.961 0.8 . . . . 0.0 112.966 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -143.91 2.98 1.22 Allowed 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -177.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 82.4 -178.83 53.33 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 123.332 0.491 . . . . 0.0 112.009 -176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.7 mt -143.53 158.7 43.45 Favored 'General case' 0 C--N 1.334 -0.099 0 C-N-CA 123.631 0.772 . . . . 0.0 109.109 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -68.73 -14.26 62.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.21 0.204 . . . . 0.0 111.428 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -120.43 27.25 8.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.694 0.798 . . . . 0.0 111.536 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -176.58 -154.46 11.83 Favored Glycine 0 C--N 1.337 0.613 0 O-C-N 121.549 -0.719 . . . . 0.0 111.35 -178.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -132.97 -11.43 2.96 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 20.0 t -127.08 156.03 42.36 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.036 0.534 . . . . 0.0 110.279 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 90.1 p -122.7 3.74 9.52 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.598 0.759 . . . . 0.0 112.304 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -142.92 141.73 31.55 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 124.818 1.247 . . . . 0.0 114.331 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -155.13 156.68 36.21 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.963 -0.46 . . . . 0.0 111.382 -177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -119.84 132.54 55.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.695 1.198 . . . . 0.0 112.943 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -122.25 3.39 9.79 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 98.0 p -68.9 -17.57 63.99 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.568 0.347 . . . . 0.0 111.299 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -113.96 -1.58 13.77 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.306 0.642 . . . . 0.0 111.594 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 41.3 t -75.22 146.98 40.72 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.405 0.282 . . . . 0.0 110.941 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -76.29 -17.37 59.48 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.455 0.302 . . . . 0.0 110.792 178.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -65.74 -23.62 66.78 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.486 0.315 . . . . 0.0 110.787 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -68.49 113.55 6.13 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . 0.582 HH11 ' HG2' ' A' ' 481' ' ' ARG . 6.8 ttt-85 -81.08 -29.96 34.82 Favored 'General case' 0 N--CA 1.458 -0.06 0 CA-C-N 116.818 -0.173 . . . . 0.0 111.409 -172.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -89.01 7.46 34.68 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.1 t -71.38 -18.93 62.33 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.19 149.93 71.39 Favored Pre-proline 0 C--O 1.232 0.137 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 -177.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.13 -24.52 27.91 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.026 2.484 . . . . 0.0 111.681 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -81.35 -22.68 38.24 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.164 0.438 . . . . 0.0 110.9 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.56 -39.21 17.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 O-C-N 122.097 -0.377 . . . . 0.0 110.019 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -69.01 -20.47 64.15 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.116 0.566 . . . . 0.0 111.443 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -74.42 -16.96 60.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.068 -0.395 . . . . 0.0 111.732 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -124.09 31.64 5.76 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.118 0.567 . . . . 0.0 111.773 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.89 156.84 6.2 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.311 0.577 . . . . 0.0 112.034 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.408 ' HG2' ' C6 ' ' C' ' 4' ' ' ' C' . 0.5 OUTLIER -144.23 97.58 3.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 179.711 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 35.5 mm -137.12 136.9 47.08 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.04 0 C-N-CA 122.845 0.458 . . . . 0.0 110.096 -174.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -152.09 173.42 14.93 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 110.21 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -57.28 156.58 14.69 Favored Pre-proline 0 CA--C 1.531 0.22 0 C-N-CA 123.454 0.702 . . . . 0.0 109.928 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.13 150.82 87.54 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 122.947 2.431 . . . . 0.0 110.007 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 46.0 t -155.07 166.54 33.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 -174.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -83.71 -0.91 52.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.656 0.382 . . . . 0.0 110.55 179.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -96.27 138.19 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 177.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 74.1 mt -123.14 155.01 37.87 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.07 0.548 . . . . 0.0 109.662 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -119.14 142.12 48.21 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -136.55 158.94 43.25 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 121.506 0.67 . . . . 0.0 110.2 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -150.9 168.76 23.52 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 104.181 -2.526 . . . . 0.0 104.181 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 57.54 57.51 4.29 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.864 0.465 . . . . 0.0 110.847 -174.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -135.54 110.54 10.45 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.356 0.262 . . . . 0.0 110.826 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.66 165.78 1.59 Allowed 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 124.693 3.595 . . . . 0.0 113.162 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 16.4 mt -68.37 -16.46 63.93 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.006 -176.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.93 -10.6 50.07 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 -174.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -81.61 -13.88 12.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -171.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.702 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.86 178.89 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -167.405 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.702 ' H ' HG22 ' A' ' 510' ' ' THR . 87.1 tt0 4.56 -64.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.541 1.936 . . . . 0.0 114.671 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 510' ' ' THR . 99.3 mt-10 -57.06 -43.0 81.62 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 177.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.9 -27.0 21.28 Favored 'General case' 0 C--N 1.35 0.6 0 CA-C-N 122.667 2.485 . . . . 0.0 105.712 -176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -60.12 -37.64 80.63 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 118.63 -1.228 . . . . 0.0 113.275 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -69.57 -49.67 52.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -79.61 -21.42 44.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.83 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 57.0 mt -71.93 -40.4 68.2 Favored 'Isoleucine or valine' 0 C--N 1.338 0.099 0 CA-C-N 119.006 0.821 . . . . 0.0 109.589 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 98.7 m -64.58 -33.99 77.2 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.688 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -63.29 -40.26 96.87 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -73.73 -9.34 58.56 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.655 0.382 . . . . 0.0 111.997 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 87.9 mt -107.86 -2.66 19.67 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.452 0.701 . . . . 0.0 111.606 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 75.08 -13.23 5.83 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.593 -0.56 . . . . 0.0 113.431 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 35.4 m -81.48 154.8 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.088 0 CA-C-N 118.191 0.996 . . . . 0.0 109.26 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -75.8 148.73 38.22 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 122.062 -0.399 . . . . 0.0 111.336 -176.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 53.3 ptt85 -70.79 156.23 92.28 Favored Pre-proline 0 CA--C 1.53 0.177 0 C-N-CA 123.277 0.631 . . . . 0.0 109.936 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.26 151.29 83.8 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.238 2.625 . . . . 0.0 110.959 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.5 t -87.11 -14.95 39.88 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 23.2 t -151.46 154.86 37.41 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 122.489 0.316 . . . . 0.0 110.639 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 57.8 t -143.62 146.38 21.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 C-N-CA 123.702 0.801 . . . . 0.0 110.187 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -147.26 141.61 26.33 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.488 0.715 . . . . 0.0 109.476 175.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.1 m -137.37 149.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.75 -172.44 4.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 92.0 p -140.83 -177.25 4.99 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.54 0.736 . . . . 0.0 110.628 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 96.6 -8.76 66.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 123.825 0.726 . . . . 0.0 112.142 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.51 -27.01 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.83 0.815 . . . . 0.0 111.017 177.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 80.2 p -165.07 165.75 19.72 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.414 0.686 . . . . 0.0 109.619 176.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.4 pm0 -96.85 -5.72 37.58 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.057 0.543 . . . . 0.0 110.915 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -77.61 -47.43 19.35 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 88.1 p -163.05 172.65 14.65 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.145 0.498 . . . . 0.0 110.929 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 42.1 t -77.41 167.3 21.91 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.336 0.589 . . . . 0.0 111.174 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 91.9 p -148.48 163.51 36.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 176.32 -165.87 36.55 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 119.772 -1.204 . . . . 0.0 113.485 -177.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.88 159.23 25.94 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.809 0.844 . . . . 0.0 110.474 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.1 mt -137.71 155.39 49.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.953 1.301 . . . . 0.0 108.134 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -145.8 147.42 31.84 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 118.147 0.43 . . . . 0.0 111.498 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -124.67 171.08 10.35 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.929 1.292 . . . . 0.0 112.075 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -73.07 -12.22 60.83 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 47.4 t -157.52 164.48 37.32 Favored 'General case' 0 C--O 1.231 0.119 0 O-C-N 121.806 -0.559 . . . . 0.0 111.097 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -70.78 -29.2 65.33 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.477 0.311 . . . . 0.0 110.713 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 82.3 p -76.25 -26.34 55.89 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 178.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.35 -36.93 74.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.968 0.507 . . . . 0.0 111.476 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.53 -28.51 56.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.465 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 52.0 tp -74.03 -40.88 62.57 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.23 -0.294 . . . . 0.0 111.235 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.64 -36.81 73.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.622 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 2.5 m -70.31 -27.71 64.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 176.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . . . . . . . . . 21.6 tp -65.23 -39.27 92.51 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -66.04 -47.22 75.33 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -84.51 -27.09 27.64 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 27.6 tp -93.66 -20.0 20.59 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -69.99 149.88 47.26 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.315 0.507 . . . . 0.0 110.211 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 57.31 22.65 7.98 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.738 1.215 . . . . 0.0 113.122 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -65.44 134.75 54.14 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 177.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -76.61 121.08 22.7 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 122.476 0.31 . . . . 0.0 110.707 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 68.3 mtm -90.4 152.62 20.91 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -66.72 162.83 20.44 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.131 0.573 . . . . 0.0 109.969 172.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -150.36 119.17 3.64 Favored Pre-proline 0 CA--C 1.532 0.285 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.03 -18.92 20.94 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.402 2.735 . . . . 0.0 114.164 -173.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -156.37 -5.76 0.11 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -177.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -74.7 157.8 50.87 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 118.715 0.689 . . . . 0.0 111.578 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.45 -19.86 28.12 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.786 2.991 . . . . 0.0 111.876 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -153.6 153.94 29.7 Favored Pre-proline 0 N--CA 1.455 -0.217 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.67 164.51 35.47 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.298 2.665 . . . . 0.0 111.002 176.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -129.94 142.32 50.66 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 102.997 -2.964 . . . . 0.0 102.997 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.25 0.8 OUTLIER -84.96 140.3 31.18 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 115.321 1.601 . . . . 0.0 115.321 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 7.7 tt -78.26 147.14 34.48 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.28 147.97 52.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.401 -0.519 . . . . 0.0 110.619 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 2.0 pp -156.26 164.01 38.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.234 0.54 . . . . 0.0 111.245 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 24.6 p -162.24 175.33 11.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.269 1.028 . . . . 0.0 110.038 -178.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -57.97 125.83 24.82 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . . . . . . . . . 29.9 t -81.83 150.64 27.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -172.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.27 0.7 OUTLIER -114.54 10.3 16.82 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 114.852 1.426 . . . . 0.0 114.852 169.836 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.63 163.4 21.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.215 1.006 . . . . 0.0 111.906 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -96.95 -0.78 46.96 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.437 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -155.09 168.56 26.61 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.629 0.772 . . . . 0.0 110.293 -178.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -145.92 20.46 1.44 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.492 0.717 . . . . 0.0 110.381 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.457 -1.259 . . . . 0.0 110.765 -175.564 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.426 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.789 0 O4'-C1'-N19 112.059 3.859 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.797 0 O4'-C1'-N19 111.567 3.367 . 0.429 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.535 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.953 0 O4'-C1'-N19 111.047 2.847 OUTLIER-DELTA 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 C5'-C4'-C3' 110.296 -3.469 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . 0.424 " H5'" ' C8 ' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.418 -2.893 1 O4'-C1'-N19 112.303 4.103 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.497 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 0 C3'-C2'-C1' 104.834 3.705 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C5'-C4'-C3' 110.818 -3.121 . 0.099 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.901 0 C3'-C2'-C1' 105.032 3.925 . 0.034 0b . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.408 ' C6 ' ' HG2' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.419 -2.822 0 O4'-C1'-N19 110.853 2.653 . 0.124 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.735 1 C5'-C4'-C3' 108.814 -4.458 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.285 17.5 t80 . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . 66.67 49.66 53.97 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 119.334 -0.703 . . . . 0.0 112.584 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.35 163.15 37.54 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.618 2.878 . . . . 0.0 111.183 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -155.2 158.54 39.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.165 0.586 . . . . 0.0 110.422 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -72.83 160.61 31.88 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.873 0.368 . . . . 0.0 111.237 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -73.98 -6.6 48.34 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 29.3 t -158.85 146.93 13.7 Favored Pre-proline 0 N--CA 1.456 -0.138 0 C-N-CA 122.759 0.424 . . . . 0.0 110.49 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -12.74 34.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.492 2.795 . . . . 0.0 110.742 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.51 148.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 C-N-CA 122.846 0.458 . . . . 0.0 112.182 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 1.9 tt -140.28 155.71 46.74 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 14.5 tpt -139.05 131.61 28.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.241 0.473 . . . . 0.0 110.811 -174.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.5 p -125.26 155.12 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.479 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 5.2 m-85 -144.8 175.11 10.43 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -176.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 84.24 9.62 81.7 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.071 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.81 26.79 0.4 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.467 0.707 . . . . 0.0 112.461 -177.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.6 -40.74 97.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.462 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 6.8 pm0 -66.43 148.61 51.62 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.122 0.487 . . . . 0.0 111.201 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 67.3 m -70.08 -8.02 46.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -174.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -72.93 -15.4 61.57 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 122.58 0.352 . . . . 0.0 111.455 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 51.6 mmm -90.72 148.0 22.88 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.924 0.392 . . . . 0.0 110.814 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -162.23 159.75 26.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.296 1.038 . . . . 0.0 108.284 175.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 21.9 p -59.92 -30.77 69.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -176.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -74.99 -37.04 61.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.048 0.386 . . . . 0.0 111.779 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 12.6 mmp_? -70.81 -51.5 26.37 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 122.726 0.41 . . . . 0.0 110.231 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 38.1 t -69.08 -43.03 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.138 0.575 . . . . 0.0 109.743 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.29 -29.48 57.41 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -73.79 -33.67 64.32 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 120.124 1.329 . . . . 0.0 109.839 179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . 0.411 HG22 ' CD2' ' A' ' 556' ' ' LEU . 17.6 t -57.31 -57.06 11.61 Favored 'Isoleucine or valine' 0 C--N 1.342 0.272 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.558 2.8 p90 -76.49 -4.03 40.48 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 117.758 2.503 . . . . 0.0 117.758 175.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . . . . . . . . . 41.2 t -76.37 -33.15 58.91 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.881 -0.512 . . . . 0.0 111.085 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 3.0 pp -60.81 -14.86 24.4 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -84.51 -9.78 58.03 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 172.17 -151.71 15.35 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.354 0.525 . . . . 0.0 112.233 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -99.57 126.15 45.5 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.551 0.34 . . . . 0.0 110.961 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.1 m -114.02 165.47 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.127 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.86 -62.76 1.22 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -144.28 161.17 39.6 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -169.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.14 150.32 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.45 1.1 . . . . 0.0 109.162 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -157.47 132.42 8.76 Favored 'General case' 0 CA--C 1.527 0.096 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.251 3.8 m-85 -82.89 163.66 20.98 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 116.318 1.969 . . . . 0.0 116.318 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 20.7 mmt -122.43 123.14 40.63 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 122.838 0.455 . . . . 0.0 111.959 -177.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.006 0.523 . . . . 0.0 111.254 169.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 93.9 p -77.91 -7.76 57.18 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.292 0.637 . . . . 0.0 112.432 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -132.13 159.47 72.04 Favored Pre-proline 0 CA--C 1.529 0.147 0 C-N-CA 124.131 0.973 . . . . 0.0 109.319 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.18 -16.43 54.87 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.92 2.413 . . . . 0.0 111.013 177.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 173.5 101.16 0.14 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 175.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -155.25 158.55 39.01 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.428 0.691 . . . . 0.0 109.75 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -156.19 153.88 29.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.008 0.433 . . . . 0.0 110.985 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . . . . . . . . . 45.3 ttm -107.39 151.19 25.84 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.024 0.929 . . . . 0.0 108.749 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 3.7 t -136.83 152.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 123.299 0.639 . . . . 0.0 111.599 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -132.12 128.93 39.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 27.2 mtp -152.53 171.11 18.62 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -170.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.445 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -66.92 125.65 26.61 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 169.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -73.31 -29.63 62.83 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -63.94 -83.65 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 -178.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -72.66 -36.48 67.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.72 -33.32 18.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 119.944 1.247 . . . . 0.0 114.151 -169.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 52.5 t -88.88 -24.49 6.0 Favored 'Isoleucine or valine' 0 C--N 1.342 0.258 0 CA-C-N 120.13 1.332 . . . . 0.0 109.858 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -70.84 -50.83 31.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -65.11 -35.21 80.4 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.36 77.55 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.576 0.625 . . . . 0.0 110.552 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 72.6 mt -79.91 -9.1 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.088 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 26.0 m -98.85 -20.18 16.98 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -129.17 -29.52 2.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -169.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.06 -13.09 7.37 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.623 1.556 . . . . 0.0 113.56 -173.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.641 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 18.7 p-10 -71.62 100.79 2.36 Favored 'General case' 0 C--O 1.201 -1.46 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -167.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.3 m-80 76.65 22.04 1.21 Allowed 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 123.666 2.939 . . . . 0.0 113.207 -162.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -79.25 163.19 25.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.494 -0.754 . . . . 0.0 109.425 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.39 135.94 36.27 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 19.6 ttt -157.67 142.61 16.7 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 59.55 18.5 7.07 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 116.53 2.048 . . . . 0.0 116.53 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.31 11.38 85.39 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 -174.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -134.51 -162.86 1.3 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.439 1.496 . . . . 0.0 108.474 -179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -136.86 149.72 47.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-O 120.95 0.405 . . . . 0.0 111.023 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 13.9 ptm -127.45 83.59 2.18 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.116 0.966 . . . . 0.0 108.873 178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 8.2 m120 -55.92 127.96 32.83 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-O 115.759 -2.067 . . . . 0.0 112.21 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.641 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.43 2.0 t -128.54 152.66 36.98 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 113.48 -3.288 . . . . 0.0 116.51 169.208 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 40.6 t -160.3 167.44 27.49 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.375 1.47 . . . . 0.0 107.974 177.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.6 p -70.23 146.4 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 29.5 t -83.03 166.02 19.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.827 0.451 . . . . 0.0 111.253 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.16 12.48 7.12 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -85.33 151.85 57.1 Favored Pre-proline 0 N--CA 1.456 -0.151 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 170.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.05 -36.56 4.21 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.789 2.326 . . . . 0.0 112.506 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -169.89 158.78 7.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.764 0.425 . . . . 0.0 111.42 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -75.31 130.53 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.5 mmm -97.08 118.6 64.59 Favored Pre-proline 0 N--CA 1.454 -0.254 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.512 175.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.19 163.45 32.69 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 123.167 2.578 . . . . 0.0 109.772 175.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . 148.52 -144.52 12.35 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -72.45 152.32 42.03 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.373 0.669 . . . . 0.0 109.83 -179.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 89.1 p -151.92 166.19 32.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.989 0.424 . . . . 0.0 111.439 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -84.63 -4.42 58.99 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 76.68 -177.69 51.35 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 97.7 mt -141.85 157.44 45.0 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.977 0.911 . . . . 0.0 108.996 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -75.37 -12.03 60.17 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.364 -0.21 . . . . 0.0 111.452 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -120.4 26.64 9.07 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.668 0.787 . . . . 0.0 110.122 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -167.92 -154.19 8.56 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -177.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 41.6 t -133.05 -26.11 1.74 Allowed 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.613 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 98.0 m -127.01 155.96 42.38 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.485 0.714 . . . . 0.0 110.338 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.4 p -75.93 -23.08 55.42 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -95.26 148.49 22.36 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -157.15 157.49 34.54 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.088 0.555 . . . . 0.0 109.901 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -134.35 153.19 52.03 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -128.01 2.67 5.9 Favored 'General case' 0 CA--C 1.527 0.091 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 92.3 p -66.07 -17.73 64.88 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.6 0.36 . . . . 0.0 111.762 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.05 2.07 14.83 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.405 0.682 . . . . 0.0 111.321 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 39.9 t -82.33 -7.85 59.63 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.962 0.505 . . . . 0.0 112.014 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . 0.406 ' NH2' " H2'" ' C' ' 2' ' ' ' C' . 49.7 ttt180 62.4 -7.96 0.12 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.126 1.37 . . . . 0.0 113.155 -177.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . 0.504 HD21 ' CD2' ' A' ' 561' ' ' HIS . 63.9 m-20 -65.56 -15.8 63.07 Favored 'General case' 0 C--O 1.231 0.093 0 O-C-N 121.685 -0.635 . . . . 0.0 112.581 -178.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -55.56 125.34 20.61 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -72.97 -33.77 66.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -169.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.376 57.1 m-85 -98.19 8.15 45.22 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 117.946 2.573 . . . . 0.0 117.946 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 41.7 t -76.16 -13.78 60.18 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.1 p -132.44 149.56 73.46 Favored Pre-proline 0 C--O 1.231 0.087 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -71.58 -23.87 22.7 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 C-N-CA 123.28 2.653 . . . . 0.0 111.624 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -76.56 -25.34 53.95 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.133 0.424 . . . . 0.0 110.317 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -86.68 -48.29 8.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -65.18 -19.53 66.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.476 0.71 . . . . 0.0 112.765 -171.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.62 -29.22 62.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.243 0.474 . . . . 0.0 111.388 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -124.06 10.25 8.77 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -60.46 154.51 20.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 118.663 0.665 . . . . 0.0 112.719 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -155.34 138.71 15.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 47.2 mt -142.12 142.74 27.37 Favored 'Isoleucine or valine' 0 C--O 1.231 0.085 0 C-N-CA 123.449 0.7 . . . . 0.0 109.511 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -148.27 173.39 13.07 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 123.801 0.841 . . . . 0.0 110.336 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -58.73 153.9 39.21 Favored Pre-proline 0 CA--C 1.53 0.206 0 C-N-CA 123.296 0.638 . . . . 0.0 110.049 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.22 147.44 88.07 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 123.087 2.525 . . . . 0.0 110.267 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 47.4 t -152.67 174.49 13.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.388 0.675 . . . . 0.0 109.771 -174.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -83.68 -0.64 51.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -178.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.9 t -99.71 136.45 30.9 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 552' ' ' ALA . 4.6 mm? -121.14 156.23 32.79 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 123.805 0.842 . . . . 0.0 109.644 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -127.1 142.35 51.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -136.6 158.95 43.24 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.305 0.574 . . . . 0.0 111.257 -176.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -150.16 164.49 35.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 103.403 -2.814 . . . . 0.0 103.403 -177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 34.0 m120 58.53 56.79 4.11 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.949 0.5 . . . . 0.0 111.104 -172.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -122.02 151.94 59.06 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.724 0.41 . . . . 0.0 111.174 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.57 154.26 37.45 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.467 2.778 . . . . 0.0 112.118 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.78 -16.55 63.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.98 0.512 . . . . 0.0 111.675 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -122.83 27.71 7.6 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 123.701 0.8 . . . . 0.0 110.968 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 5.8 p -63.64 -17.01 19.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.715 HG22 ' H ' ' A' ' 511' ' ' GLU . 1.0 OUTLIER -54.54 -177.91 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 114.233 1.198 . . . . 0.0 114.233 -164.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.715 ' H ' HG22 ' A' ' 510' ' ' THR . 22.7 pt-20 -21.34 -41.77 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.794 1.638 . . . . 0.0 115.215 -169.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 510' ' ' THR . 93.5 mt-10 -57.6 -47.2 82.81 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 172.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -86.3 -27.01 24.62 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 121.709 2.049 . . . . 0.0 106.631 -173.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -67.12 -36.26 81.52 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -76.84 -38.65 53.38 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -73.58 -28.66 61.96 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.398 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.66 -44.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 O-C-N 121.966 -0.459 . . . . 0.0 110.969 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 31.2 p -69.12 -25.44 64.4 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.183 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.96 -42.46 85.16 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -70.41 -18.3 63.02 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 70.8 mt -96.07 -6.01 39.62 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.653 0.381 . . . . 0.0 111.415 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 72.59 -11.87 3.96 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 123.875 0.75 . . . . 0.0 113.769 177.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 24.1 m -77.79 159.37 4.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 118.194 0.997 . . . . 0.0 110.45 177.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -68.9 153.68 43.36 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.113 0.482 . . . . 0.0 111.627 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 54.2 ptt85 -76.08 157.03 83.76 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 123.48 0.712 . . . . 0.0 110.692 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.26 160.09 51.2 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.343 2.696 . . . . 0.0 111.015 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 1.9 t -95.25 -15.75 22.98 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 24.1 t -154.22 159.99 41.61 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 122.793 0.437 . . . . 0.0 110.313 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 4.6 p -153.29 150.08 12.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -145.6 141.06 27.83 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 124.0 0.92 . . . . 0.0 109.071 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 25.0 t -139.9 141.46 34.12 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 C-N-CA 123.524 0.729 . . . . 0.0 110.023 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -152.67 167.23 29.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 -177.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 36.7 t -89.76 170.72 10.19 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.654 0.782 . . . . 0.0 110.763 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 536' ' ' SER . . . 92.27 -178.07 39.9 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 123.751 0.691 . . . . 0.0 112.048 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 41.0 mttm 62.53 -12.08 0.07 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.083 1.753 . . . . 0.0 113.698 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 534' ' ' GLY . 44.5 t -165.6 162.02 18.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.451 0.701 . . . . 0.0 110.466 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -116.95 -5.78 11.46 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.376 0.67 . . . . 0.0 110.104 174.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -91.98 -31.32 15.66 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.747 0.819 . . . . 0.0 112.275 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.7 p -159.11 168.92 25.4 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 121.089 0.471 . . . . 0.0 111.563 -171.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 32.9 t -89.5 170.93 10.09 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.847 0.859 . . . . 0.0 110.97 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.5 t -148.65 159.87 43.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.245 1.018 . . . . 0.0 109.186 178.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 177.71 -171.79 44.42 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.001 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 159.8 27.05 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.813 0.845 . . . . 0.0 110.441 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.0 mt -140.87 159.22 42.68 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.675 1.19 . . . . 0.0 108.859 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -150.32 148.74 29.2 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 122.102 -0.374 . . . . 0.0 111.745 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -126.72 171.36 11.25 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.106 1.362 . . . . 0.0 112.075 178.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -74.59 -10.41 59.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.59 0.356 . . . . 0.0 110.567 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 30.2 t -157.66 157.13 32.99 Favored 'General case' 0 C--O 1.231 0.123 0 O-C-N 121.698 -0.626 . . . . 0.0 110.444 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -75.04 -19.69 59.91 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.019 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 75.1 m -80.84 -29.45 35.86 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 118.188 0.449 . . . . 0.0 110.181 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -70.99 -36.47 72.49 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 121.41 0.624 . . . . 0.0 111.219 171.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 500' ' ' LEU . . . -72.22 -27.01 62.26 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.663 177.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 44.2 tp -79.82 -45.22 19.13 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.596 0.358 . . . . 0.0 111.539 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.5 -33.46 75.97 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -73.81 -28.15 61.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 175.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' A' ' 399' ' ' VAL . 1.8 tt -70.38 -35.18 73.34 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 171.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -57.36 -49.45 72.74 Favored Glycine 0 C--N 1.335 0.519 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.305 35.1 m-85 -84.07 -11.78 56.16 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 118.395 2.739 . . . . 0.0 118.395 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 76.3 mt -103.15 -20.68 14.07 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.823 0.738 . . . . 0.0 112.859 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -70.64 139.39 51.31 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 119.315 0.962 . . . . 0.0 109.532 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.504 ' CD2' HD21 ' A' ' 479' ' ' ASN . 2.4 t-80 55.96 17.12 2.43 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.031 1.332 . . . . 0.0 113.444 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.255 32.7 t80 -72.68 139.4 47.25 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -69.7 140.76 53.57 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 121.958 -0.464 . . . . 0.0 112.193 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 76.4 mtm -83.57 152.66 24.74 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.921 0.391 . . . . 0.0 111.362 175.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -74.45 161.28 29.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -149.17 122.38 4.51 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 122.2 0.2 . . . . 0.0 110.636 -178.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.27 -24.4 7.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.567 2.845 . . . . 0.0 112.623 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -156.1 -1.17 0.13 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -177.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -70.14 153.05 51.7 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.49 -26.67 16.62 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.351 2.701 . . . . 0.0 111.309 -178.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -155.89 151.82 22.63 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 178.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.82 159.17 48.94 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.381 2.721 . . . . 0.0 111.196 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -130.01 142.32 50.64 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 102.731 -3.062 . . . . 0.0 102.731 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.263 0.6 OUTLIER -76.55 141.46 41.17 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 -176.271 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -84.41 138.15 32.99 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.3 1.44 . . . . 0.0 107.658 173.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.31 150.08 51.71 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 118.091 0.405 . . . . 0.0 110.308 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.25 162.79 40.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.173 0.511 . . . . 0.0 111.247 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 25.6 p -158.57 167.6 29.16 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.823 0.849 . . . . 0.0 110.378 -178.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -56.0 122.91 12.69 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.454 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 35.1 t -80.12 153.38 28.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -169.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 t -119.05 12.43 12.73 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.16 0.984 . . . . 0.0 113.434 169.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.03 20.19 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.138 0.975 . . . . 0.0 111.88 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -92.62 -3.49 54.88 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.571 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -153.9 171.49 18.9 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 123.75 0.82 . . . . 0.0 110.436 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -148.63 24.91 0.97 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.471 0.708 . . . . 0.0 110.198 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.604 -1.188 . . . . 0.0 110.439 -176.629 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.479 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.42 -2.79 0 O4'-C1'-N19 112.188 3.988 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C5'-C4'-C3' 110.477 -3.349 . 0.385 2[ . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.931 2 C5'-C4'-C3' 105.812 -6.459 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.645 1 C5'-C4'-C3' 108.817 -4.455 . 0.01 2u . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.603 1 O4'-C1'-N19 113.994 5.794 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C3'-C2'-C1' 104.861 3.735 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . 0.406 " H2'" ' NH2' ' A' ' 478' ' ' ARG . . . . . . . . 0 O4'--C4' 1.42 -2.762 0 C5'-C4'-C3' 111.22 -2.853 . 0.232 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -3.085 0 C3'-C2'-C1' 104.378 3.198 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.454 ' N3 ' ' HA ' ' A' ' 580' ' ' SER . . . . . . . . 0 O4'--C4' 1.42 -2.761 0 O4'-C1'-N19 111.56 3.36 . 0.243 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.73 1 C5'-C4'-C3' 108.732 -4.512 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . 0.284 16.6 t80 . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 373' ' ' GLY . . . . . . . . . . . . . . . -178.9 -174.82 45.43 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 374' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.34 165.29 5.83 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 124.683 3.589 . . . . 0.0 112.724 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 375' ' ' HIS . . . . . . . . . . . . . 43.8 p-80 -150.17 155.71 40.27 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.016 0.526 . . . . 0.0 110.569 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 376' ' ' ALA . . . . . . . . . . . . . . . -74.83 161.15 29.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -76.61 -8.83 58.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.771 0.428 . . . . 0.0 110.272 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 378' ' ' SER . . . . . . . . . . . . . 31.0 t -157.29 147.77 16.03 Favored Pre-proline 0 CA--C 1.527 0.086 0 O-C-N 121.7 -0.625 . . . . 0.0 110.74 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.91 -17.21 46.57 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.239 2.626 . . . . 0.0 110.539 173.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.1 151.49 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 381' ' ' LEU . . . . . . . . . . . . . 3.1 tt -141.38 155.12 45.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.676 1.19 . . . . 0.0 108.338 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 382' ' ' MET . . . . . . . . . . . . . 43.9 tpp -136.63 137.52 40.19 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.343 0.257 . . . . 0.0 110.827 -176.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . . . . . . . . . 2.4 p -131.69 150.91 34.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.54 ' CE1' " H2'" ' B' ' 1' ' ' ' A' . 9.9 m-85 -138.04 175.69 9.36 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 -178.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 83.75 12.34 77.73 Favored Glycine 0 CA--C 1.528 0.892 0 N-CA-C 112.014 -0.434 . . . . 0.0 112.014 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.22 25.95 0.57 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.343 0.657 . . . . 0.0 111.655 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 387' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -64.86 -40.21 94.79 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -176.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 388' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 388' ' ' GLN . 7.1 pm0 -67.94 147.85 51.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.0 0.429 . . . . 0.0 110.582 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 389' ' ' SER . . . . . . . . . . . . . 49.9 m -70.54 -8.47 51.64 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -72.95 -17.19 61.5 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 118.124 0.42 . . . . 0.0 111.42 178.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 391' ' ' MET . . . . . . . . . . . . . 66.3 mmm -85.18 148.14 26.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.088 0.403 . . . . 0.0 110.588 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 392' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.38 155.52 22.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 393' ' ' CYS . . . . . . . . . . . . . 23.9 p -61.29 -30.56 70.56 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 394' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -72.45 -39.46 67.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.763 0.316 . . . . 0.0 110.559 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 395' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -76.06 -41.18 51.48 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 29.0 t -71.06 -43.65 75.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 397' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -75.1 -30.01 60.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 0.409 ' HA ' ' HB3' ' A' ' 401' ' ' CYS . 1.4 p30 -78.23 -28.31 47.85 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.018 1.281 . . . . 0.0 110.234 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 399' ' ' VAL . . . . . 0.49 HG22 HD12 ' A' ' 556' ' ' LEU . 2.4 t -59.53 -57.02 13.43 Favored 'Isoleucine or valine' 0 C--N 1.341 0.222 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -178.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 400' ' ' PHE . . . . . . . . . . . . 0.551 1.6 p90 -76.65 -5.71 49.03 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 173.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 401' ' ' CYS . . . . . 0.409 ' HB3' ' HA ' ' A' ' 398' ' ' ASN . 48.7 t -71.37 -32.27 68.29 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 117.973 0.351 . . . . 0.0 110.609 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pp -62.59 -14.99 48.97 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 120.321 -0.551 . . . . 0.0 111.279 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 403' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -90.5 -2.16 57.91 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 117.811 2.523 . . . . 0.0 117.811 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . . . . . . . . . . . 166.0 -170.16 40.59 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 118.748 0.703 . . . . 0.0 113.054 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 405' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -83.07 132.62 35.11 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 122.54 -0.388 . . . . 0.0 110.797 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.94 165.53 8.82 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.096 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -177.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -122.49 -68.83 0.86 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.423 0.289 . . . . 0.0 111.522 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 408' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -154.54 174.44 14.93 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.219 0.463 . . . . 0.0 112.091 -177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 409' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.47 149.94 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 C-N-CA 124.426 1.09 . . . . 0.0 109.531 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -155.27 130.21 9.38 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 122.854 0.461 . . . . 0.0 111.314 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . 0.279 3.7 m-85 -80.98 152.09 28.15 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 178.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 412' ' ' MET . . . . . 0.461 ' HE3' ' HG3' ' A' ' 420' ' ' MET . 34.7 mmt -73.5 134.17 43.8 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-O 121.111 0.481 . . . . 0.0 111.808 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -79.21 -33.96 43.29 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.898 0.879 . . . . 0.0 111.974 178.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 414' ' ' SER . . . . . . . . . . . . . 70.7 m -102.05 -17.91 15.85 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -174.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 415' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -91.74 150.27 40.59 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 118.445 0.566 . . . . 0.0 110.562 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 416' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.18 -12.81 23.42 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.668 2.912 . . . . 0.0 112.432 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 178.82 81.42 0.06 OUTLIER Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.334 -0.706 . . . . 0.0 111.334 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 418' ' ' ALA . . . . . . . . . . . . . . . -156.69 161.34 39.85 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.062 0.545 . . . . 0.0 109.87 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -158.95 149.28 19.54 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 420' ' ' MET . . . . . 0.461 ' HG3' ' HE3' ' A' ' 412' ' ' MET . 78.5 mtp -93.6 151.51 19.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.973 0.909 . . . . 0.0 109.588 172.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 7.0 t -143.9 154.24 15.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 -177.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 422' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -138.71 133.79 32.72 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 28.1 mtm -153.24 175.59 12.9 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 124.238 1.015 . . . . 0.0 109.5 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 428' ' ' ALA . . . -64.45 123.57 19.56 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 172.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -72.43 -32.41 66.3 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -167.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -56.83 -89.39 0.01 OUTLIER Glycine 0 C--N 1.339 0.705 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -71.68 -29.12 64.24 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 116.672 2.101 . . . . 0.0 116.672 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 424' ' ' ALA . . . -87.47 -35.15 18.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.765 -172.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' VAL . . . . . . . . . . . . . 55.8 t -89.3 -26.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 118.319 -1.352 . . . . 0.0 109.447 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -68.56 -49.27 60.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.064 175.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -70.41 -31.37 68.54 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.66 78.31 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.876 0.762 . . . . 0.0 110.213 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' ILE . . . . . . . . . . . . . 62.3 mt -79.04 -15.59 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.121 0.569 . . . . 0.0 110.882 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' THR . . . . . . . . . . . . . 31.7 m -91.01 -20.66 21.86 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -123.46 -29.55 3.77 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 -169.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 93.0 mt -134.42 -5.53 2.59 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -171.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' ASN . . . . . 0.64 ' CB ' ' HB ' ' A' ' 448' ' ' VAL . 0.0 OUTLIER -71.65 100.99 2.42 Favored 'General case' 0 C--O 1.204 -1.341 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -169.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 447' ' ' ASN . 11.9 m-80 77.21 22.06 1.02 Allowed 'General case' 0 N--CA 1.483 1.216 0 O-C-N 117.713 -3.117 . . . . 0.0 113.019 -160.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -83.08 156.96 23.04 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.946 -1.096 . . . . 0.0 109.752 167.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . 0.252 21.8 m-85 -74.71 142.59 44.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' MET . . . . . . . . . . . . . 28.2 ttt -161.51 140.16 9.66 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.433 0.693 . . . . 0.0 109.901 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' PHE . . . . . . . . . . . . 0.386 47.7 m-85 56.83 27.21 12.57 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 117.77 2.508 . . . . 0.0 117.77 -179.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 78.7 7.56 88.12 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -133.71 -163.49 1.37 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.953 1.301 . . . . 0.0 108.211 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -138.88 146.33 41.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.29 107.31 10.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' ASN . . . . . 0.594 ' HA ' ' HA ' ' A' ' 438' ' ' ASN . 3.6 m-20 -69.35 133.92 48.42 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-O 115.653 -2.118 . . . . 0.0 111.813 -171.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' VAL . . . . . 0.64 ' HB ' ' CB ' ' A' ' 437' ' ' ASN 0.465 2.0 t -125.11 151.18 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 113.191 -3.404 . . . . 0.0 115.132 168.44 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' CYS . . . . . . . . . . . . . 38.7 t -161.48 165.98 27.85 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.807 1.243 . . . . 0.0 108.269 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' VAL . . . . . . . . . . . . . 3.1 p -70.98 148.32 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' SER . . . . . . . . . . . . . 25.9 t -85.52 159.79 19.82 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.963 0.505 . . . . 0.0 110.969 177.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.458 ' HE2' " H2'" ' B' ' 2' ' ' ' C' . 64.7 pttt -105.13 0.02 27.04 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 121.948 0.099 . . . . 0.0 111.144 177.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -82.16 149.68 62.9 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.46 0.704 . . . . 0.0 110.507 176.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.02 -34.27 2.31 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.225 2.617 . . . . 0.0 112.148 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -167.11 158.75 12.43 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.366 0.666 . . . . 0.0 110.452 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 51.7 mt -85.09 135.86 23.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 174.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 60.4 mmm -98.8 156.69 35.3 Favored Pre-proline 0 N--CA 1.454 -0.258 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.24 118.69 5.11 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.883 2.388 . . . . 0.0 110.418 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' GLY . . . . . . . . . . . . . . . -84.77 142.8 20.3 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 -176.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -77.74 125.6 29.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 95.6 p -77.79 153.39 32.89 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.864 0.364 . . . . 0.0 111.194 -176.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -139.83 -5.82 1.32 Allowed 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 78.87 118.32 0.24 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.278 0.942 . . . . 0.0 111.385 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 89.3 mt -77.36 160.22 28.94 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -69.3 -15.42 63.34 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 122.126 -0.359 . . . . 0.0 111.671 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -120.47 24.9 10.11 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.29 0.636 . . . . 0.0 110.186 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -164.94 -160.31 12.24 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 121.698 -0.626 . . . . 0.0 111.698 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 71.9 m -132.97 -5.54 3.11 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 95.1 m -127.03 155.67 42.86 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.162 0.585 . . . . 0.0 110.778 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.1 m -121.23 4.34 10.32 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.165 0.586 . . . . 0.0 110.34 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -144.82 147.77 33.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.517 1.127 . . . . 0.0 112.619 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -154.15 154.25 33.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.189 0.449 . . . . 0.0 111.374 -177.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -128.41 139.83 52.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.216 1.006 . . . . 0.0 113.387 -177.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -126.59 5.46 6.81 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 40.9 t -64.26 -27.03 68.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.713 0.405 . . . . 0.0 111.663 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -100.85 -1.36 34.92 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 122.918 0.487 . . . . 0.0 111.601 178.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 40.9 t -81.56 149.57 28.59 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.125 -0.36 . . . . 0.0 111.457 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -87.5 -4.94 58.99 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.215 0.606 . . . . 0.0 111.208 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -63.34 -19.15 64.37 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -62.18 109.15 1.22 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.199 0.6 . . . . 0.0 109.606 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -73.99 -29.27 61.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' PHE . . . . . . . . . . . . 0.305 69.7 m-85 -97.98 15.14 24.95 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' SER . . . . . . . . . . . . . 48.3 t -74.22 -14.76 60.98 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -131.06 148.37 70.0 Favored Pre-proline 0 C--O 1.233 0.214 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -177.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -72.27 -26.25 17.77 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.278 2.652 . . . . 0.0 112.063 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -79.09 -27.93 43.02 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.495 0.589 . . . . 0.0 110.007 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -77.28 -43.97 31.39 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 175.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -62.48 -19.24 63.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -82.69 -18.1 42.13 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 -1.48 8.26 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.28 162.05 15.5 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.257 0.551 . . . . 0.0 111.673 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' ARG . . . . . 0.438 ' NE ' " H2'" ' C' ' 4' ' ' ' C' . 0.0 OUTLIER -146.16 140.98 27.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.562 0.745 . . . . 0.0 109.75 178.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' ILE . . . . . . . . . . . . . 33.5 mm -143.8 138.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -149.55 173.38 13.68 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 123.512 0.725 . . . . 0.0 110.361 -177.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -58.74 155.06 32.7 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -64.54 151.79 84.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.839 2.359 . . . . 0.0 109.351 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 48.1 t -154.51 169.17 24.43 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.793 0.437 . . . . 0.0 110.042 -174.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -83.77 -8.03 59.33 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.92 145.18 8.6 Favored 'Isoleucine or valine' 0 C--N 1.339 0.112 0 C-N-CA 123.34 0.656 . . . . 0.0 111.887 173.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 7.0 tp -138.05 153.16 49.36 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -126.95 148.38 50.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.678 0.791 . . . . 0.0 109.103 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -144.53 160.77 40.58 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.555 0.693 . . . . 0.0 109.746 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -152.75 164.9 36.9 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 104.01 -2.589 . . . . 0.0 104.01 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 59.11 57.6 3.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.919 0.488 . . . . 0.0 111.971 -173.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' ALA . . . . . . . . . . . . . . . -119.44 153.52 53.85 Favored Pre-proline 0 CA--C 1.532 0.268 0 C-N-CA 123.042 0.537 . . . . 0.0 110.454 177.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.07 159.19 54.11 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.373 2.049 . . . . 0.0 110.229 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.46 -16.53 63.93 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.603 0.361 . . . . 0.0 111.498 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -109.27 19.04 19.86 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.248 0.619 . . . . 0.0 111.449 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' VAL . . . . . . . . . . . . . 3.8 p -63.26 -18.91 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.079 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -175.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.607 HG22 ' H ' ' A' ' 511' ' ' GLU . 0.2 OUTLIER -54.86 -177.38 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 117.852 -1.07 . . . . 0.0 113.772 -165.541 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' GLU . . . . . 0.607 ' H ' HG22 ' A' ' 510' ' ' THR . 23.1 pt-20 -25.92 -37.9 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -169.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 510' ' ' THR . 94.2 mt-10 -58.21 -48.08 81.48 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 117.142 -1.409 . . . . 0.0 114.451 171.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -86.63 -27.14 24.0 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 122.529 2.422 . . . . 0.0 106.686 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -65.09 -38.59 91.2 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 176.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -74.88 -37.84 62.04 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -80.43 -22.05 41.57 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.542 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' ILE . . . . . . . . . . . . . 50.3 mt -76.38 -43.89 35.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.418 0.554 . . . . 0.0 110.671 177.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' CYS . . . . . . . . . . . . . 29.3 p -69.28 -33.92 73.95 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 118.729 0.695 . . . . 0.0 110.307 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -72.46 -26.2 61.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 41.2 tp10 -75.27 -26.71 58.99 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.284 0.234 . . . . 0.0 110.626 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' LEU . . . . . . . . . . . . . 85.9 mt -95.96 -2.9 46.11 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.231 0.613 . . . . 0.0 111.738 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . 77.06 -1.19 64.45 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 123.416 0.532 . . . . 0.0 112.832 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 4.0 t -76.92 151.6 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 CA-C-N 117.995 0.897 . . . . 0.0 111.74 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -67.15 150.18 49.49 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.017 0.437 . . . . 0.0 110.38 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -76.98 152.61 82.54 Favored Pre-proline 0 CA--C 1.531 0.221 0 C-N-CA 123.012 0.525 . . . . 0.0 110.716 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.93 156.85 61.88 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.533 2.822 . . . . 0.0 110.631 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 2.6 t -89.71 -18.09 27.06 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' SER . . . . . . . . . . . . . 37.8 t -154.64 160.64 41.55 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 120.494 0.188 . . . . 0.0 110.842 176.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.81 146.54 9.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -177.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -147.23 141.13 25.86 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.051 0.941 . . . . 0.0 109.068 172.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.77 151.86 28.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -155.81 177.24 11.62 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 38.0 t -141.95 165.54 27.17 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.566 0.746 . . . . 0.0 109.859 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 123.96 -19.46 7.35 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.679 0.657 . . . . 0.0 111.636 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -80.24 -23.92 40.53 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 117.645 0.722 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' SER . . . . . . . . . . . . . 47.6 t -164.86 157.46 16.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.764 0.826 . . . . 0.0 109.487 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -97.0 -4.71 39.29 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.431 0.292 . . . . 0.0 110.257 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -78.13 -36.53 47.75 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 97.9 p -161.11 167.69 25.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.436 0.636 . . . . 0.0 112.325 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . . . . . . . . . 48.4 t -85.56 164.99 17.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.223 1.009 . . . . 0.0 110.738 176.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 93.6 p -150.21 162.44 40.47 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.217 1.007 . . . . 0.0 108.414 177.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' GLY . . . . . . . . . . . . . . . 171.94 -169.01 42.15 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.663 -178.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -121.12 160.23 24.15 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.978 0.911 . . . . 0.0 110.423 -177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.6 mt -142.12 163.97 31.43 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.14 1.376 . . . . 0.0 109.047 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -153.69 147.28 25.1 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.331 -0.231 . . . . 0.0 111.33 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' TRP . . . . . . . . . . . . . 19.4 m-90 -126.15 172.53 9.95 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.164 1.386 . . . . 0.0 112.33 177.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -73.5 -7.78 53.22 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 39.9 t -159.64 162.05 35.11 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 122.963 0.505 . . . . 0.0 110.674 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -69.29 -30.94 69.14 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.346 -0.221 . . . . 0.0 110.55 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' SER . . . . . . . . . . . . . 68.6 m -75.65 -23.36 56.3 Favored 'General case' 0 N--CA 1.457 -0.116 0 C-N-CA 122.087 0.155 . . . . 0.0 110.784 178.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -74.09 -36.36 64.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.016 0.436 . . . . 0.0 111.66 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -76.04 -26.39 56.55 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.292 176.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 50.9 tp -78.46 -37.55 43.22 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.367 0.267 . . . . 0.0 111.421 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -72.68 -38.25 67.64 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.16 -27.14 63.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 175.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' LEU . . . . . 0.541 HD13 ' C ' ' A' ' 556' ' ' LEU . 1.1 tm? -66.94 -41.73 86.46 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . -62.17 -31.63 79.64 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 119.691 -0.505 . . . . 0.0 112.307 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . 0.273 6.2 m-85 -94.52 -10.0 33.57 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 177.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' LEU . . . . . . . . . . . . . 89.6 mt -119.86 -8.94 9.78 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -177.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -70.48 139.15 51.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.516 1.053 . . . . 0.0 109.289 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 58.75 17.83 5.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.253 1.021 . . . . 0.0 112.997 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' TYR . . . . . . . . . . . . 0.265 29.2 t80 -68.89 138.34 54.59 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -74.0 136.6 43.19 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.782 -0.574 . . . . 0.0 112.29 -174.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 78.0 mtm -83.64 152.69 24.66 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.026 0.53 . . . . 0.0 111.79 175.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.3 158.32 29.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 170.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -152.15 118.42 3.11 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.8 -17.82 17.54 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.402 2.735 . . . . 0.0 114.163 -172.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -156.61 -11.72 0.1 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.21 0.913 . . . . 0.0 113.375 -176.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' GLY . . . . . . . . . . . . . . . -70.95 157.6 53.59 Favored Glycine 0 CA--C 1.53 0.969 0 CA-C-N 118.799 0.727 . . . . 0.0 111.483 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.0 -20.65 25.2 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.91 3.074 . . . . 0.0 111.993 -177.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -154.54 153.15 27.44 Favored Pre-proline 0 N--CA 1.454 -0.234 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.39 167.23 27.82 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.589 2.859 . . . . 0.0 110.71 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -129.96 142.38 50.65 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 102.178 -3.267 . . . . 0.0 102.178 175.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' THR . . . . . . . . . . . . 0.285 0.6 OUTLIER -82.42 138.48 34.41 Favored 'General case' 0 C--O 1.23 0.062 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -173.79 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' LEU . . . . . 0.406 HD13 ' C ' ' A' ' 575' ' ' LEU . 1.3 tm? -81.17 137.52 35.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.279 1.431 . . . . 0.0 107.694 172.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.89 147.47 52.54 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.46 161.1 40.08 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.946 0.403 . . . . 0.0 111.083 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' CYS . . . . . . . . . . . . . 26.0 p -163.73 173.68 12.57 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.8 0.84 . . . . 0.0 110.33 -177.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -53.98 124.5 15.69 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' SER . . . . . 0.419 ' HA ' ' N3 ' ' C' ' 4' ' ' ' C' . 36.6 t -77.02 153.4 34.5 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 -171.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . 0.261 1.0 OUTLIER -123.62 9.07 8.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.719 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.96 163.87 16.29 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.494 0.718 . . . . 0.0 110.704 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -82.83 0.58 43.31 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.41 165.37 1.4 Allowed 'General case' 0 C--O 1.23 0.029 0 C-N-CA 124.536 1.134 . . . . 0.0 110.196 175.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' ALA . . . . . . . . . . . . . . . -84.29 -6.68 59.42 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 177.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.394 -1.289 . . . . 0.0 111.294 -179.483 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ' A' . . . . . 0.54 " H2'" ' CE1' ' A' ' 384' ' ' TYR . . . . . . . . 0 O4'--C4' 1.421 -2.671 0 O4'-C1'-N19 112.113 3.913 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ' C' . . . . . 0.458 " H2'" ' HE2' ' A' ' 452' ' ' LYS . . . . . . . . 0 O4'--C4' 1.418 -2.875 0 C5'-C4'-C3' 110.415 -3.39 . 0.353 2[ . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ' A' . . . . . 0.512 " H5'" ' C8 ' ' B' ' 3' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.417 -2.997 0 C3'-C2'-C1' 104.837 3.708 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.312 0 C3'-C2'-C1' 104.838 3.709 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' ' A' . . . . . 0.615 ' C8 ' H5'' ' B' ' 5' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.828 1 O4'-C1'-N19 112.491 4.291 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 1' ' ' ' A' . . . . . 0.479 ' C8 ' H5'' ' C' ' 1' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.419 -2.848 0 C3'-C2'-C1' 104.729 3.588 OUTLIER-DELTA 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.793 0 C5'-C4'-C3' 111.047 -2.968 . 0.072 4b . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.978 0 C3'-C2'-C1' 104.846 3.718 . 0.0 OUTLIER '7D dist 0b' 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 4' ' ' ' C' . . . . . 0.438 " H2'" ' NE ' ' A' ' 492' ' ' ARG . . . . . . . . 0 O4'--C4' 1.419 -2.799 0 O4'-C1'-N19 110.758 2.558 . 0.226 4b . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 5' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.576 1 C5'-C4'-C3' 109.284 -4.144 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 stop_ save_